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ImagePadding -> Automatic,
|
|
|
|
BaselinePosition -> (Scaled[0.1] -> Baseline)], #4}, {
|
|
|
|
GraphicsBox[{{
|
|
|
|
Directive[
|
|
|
|
EdgeForm[
|
|
|
|
Directive[
|
|
|
|
Opacity[0.3],
|
|
|
|
GrayLevel[0]]],
|
|
|
|
PointSize[0.5],
|
|
|
|
CapForm["Butt"],
|
|
|
|
AbsoluteThickness[1.6],
|
|
|
|
Thickness[0.18],
|
|
|
|
GrayLevel[0.5]], {
|
|
|
|
LineBox[{{0, 10}, {20, 10}}]}}, {
|
|
|
|
Directive[
|
|
|
|
EdgeForm[
|
|
|
|
Directive[
|
|
|
|
Opacity[0.3],
|
|
|
|
GrayLevel[0]]],
|
|
|
|
PointSize[0.5],
|
|
|
|
CapForm["Butt"],
|
|
|
|
AbsoluteThickness[1.6],
|
|
|
|
Thickness[0.18],
|
|
|
|
GrayLevel[0.5]], {}}}, AspectRatio -> Full,
|
|
|
|
ImageSize -> {20, 10}, PlotRangePadding -> None,
|
|
|
|
ImagePadding -> Automatic,
|
|
|
|
BaselinePosition -> (Scaled[0.1] -> Baseline)], #5}},
|
|
|
|
GridBoxAlignment -> {
|
|
|
|
"Columns" -> {Center, Left}, "Rows" -> {{Baseline}}},
|
|
|
|
AutoDelete -> False,
|
|
|
|
GridBoxDividers -> {
|
|
|
|
"Columns" -> {{False}}, "Rows" -> {{False}}},
|
|
|
|
GridBoxItemSize -> {"Columns" -> {{All}}, "Rows" -> {{All}}},
|
|
|
|
GridBoxSpacings -> {
|
|
|
|
"Columns" -> {{0.5}}, "Rows" -> {{0.8}}}], "Grid"]}},
|
|
|
|
GridBoxAlignment -> {"Columns" -> {{Left}}, "Rows" -> {{Top}}},
|
|
|
|
AutoDelete -> False,
|
|
|
|
GridBoxItemSize -> {
|
|
|
|
"Columns" -> {{Automatic}}, "Rows" -> {{Automatic}}},
|
|
|
|
GridBoxSpacings -> {"Columns" -> {{1}}, "Rows" -> {{0}}}],
|
|
|
|
"Grid"], Alignment -> Left, AppearanceElements -> None,
|
|
|
|
ImageMargins -> {{5, 5}, {5, 5}}, ImageSizeAction ->
|
|
|
|
"ResizeToFit"], LineIndent -> 0, StripOnInput -> False], {
|
|
|
|
FontFamily -> "Times"}, Background -> Automatic, StripOnInput ->
|
|
|
|
False], TraditionalForm]& ),
|
|
|
|
Editable->True,
|
|
|
|
InterpretationFunction:>(RowBox[{"PointLegend", "[",
|
|
|
|
RowBox[{
|
|
|
|
RowBox[{"{",
|
|
|
|
RowBox[{
|
|
|
|
RowBox[{"Directive", "[",
|
|
|
|
RowBox[{
|
|
|
|
RowBox[{"PointSize", "[", "0.009166666666666668`", "]"}],
|
|
|
|
",",
|
|
|
|
RowBox[{"CapForm", "[", "\"Butt\"", "]"}], ",",
|
|
|
|
RowBox[{"AbsoluteThickness", "[", "1.6`", "]"}], ",",
|
|
|
|
RowBox[{"Thickness", "[", "0.01`", "]"}], ",",
|
2022-04-21 16:23:20 +02:00
|
|
|
InterpretationBox[
|
|
|
|
ButtonBox[
|
|
|
|
TooltipBox[
|
|
|
|
GraphicsBox[{{
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{0, 0}]}, {
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{1, -1}]}, {
|
|
|
|
RGBColor[1, 0.5, 0],
|
|
|
|
RectangleBox[{0, -1}, {2, 1}]}}, DefaultBaseStyle ->
|
|
|
|
"ColorSwatchGraphics", AspectRatio -> 1, Frame -> True,
|
|
|
|
FrameStyle ->
|
|
|
|
RGBColor[0.6666666666666666, 0.33333333333333337`, 0.],
|
|
|
|
FrameTicks -> None, PlotRangePadding -> None, ImageSize ->
|
|
|
|
Dynamic[{
|
|
|
|
Automatic, 1.35 CurrentValue["FontCapHeight"]/
|
|
|
|
AbsoluteCurrentValue[Magnification]}]],
|
|
|
|
StyleBox[
|
|
|
|
RowBox[{"RGBColor", "[",
|
|
|
|
RowBox[{"1", ",", "0.5`", ",", "0"}], "]"}], NumberMarks ->
|
|
|
|
False]], Appearance -> None, BaseStyle -> {},
|
|
|
|
BaselinePosition -> Baseline, DefaultBaseStyle -> {},
|
|
|
|
ButtonFunction :> With[{Typeset`box$ = EvaluationBox[]},
|
|
|
|
If[
|
|
|
|
Not[
|
|
|
|
AbsoluteCurrentValue["Deployed"]],
|
|
|
|
SelectionMove[Typeset`box$, All, Expression];
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialAlpha = 1;
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialColor =
|
|
|
|
RGBColor[1, 0.5, 0];
|
|
|
|
FrontEnd`Private`$ColorSelectorUseMakeBoxes = True;
|
|
|
|
MathLink`CallFrontEnd[
|
|
|
|
FrontEnd`AttachCell[Typeset`box$,
|
|
|
|
FrontEndResource["RGBColorValueSelector"], {
|
|
|
|
0, {Left, Bottom}}, {Left, Top},
|
|
|
|
"ClosingActions" -> {
|
|
|
|
"SelectionDeparture", "ParentChanged",
|
|
|
|
"EvaluatorQuit"}]]]], BaseStyle -> Inherited, Evaluator ->
|
|
|
|
Automatic, Method -> "Preemptive"],
|
|
|
|
RGBColor[1, 0.5, 0], Editable -> False, Selectable ->
|
|
|
|
False]}], "]"}], ",",
|
2022-02-23 12:05:42 +01:00
|
|
|
RowBox[{"Directive", "[",
|
|
|
|
RowBox[{
|
|
|
|
RowBox[{"PointSize", "[", "0.009166666666666668`", "]"}],
|
|
|
|
",",
|
|
|
|
RowBox[{"CapForm", "[", "\"Butt\"", "]"}], ",",
|
|
|
|
RowBox[{"AbsoluteThickness", "[", "1.6`", "]"}], ",",
|
|
|
|
RowBox[{"Thickness", "[", "0.01`", "]"}], ",",
|
2022-04-21 16:23:20 +02:00
|
|
|
InterpretationBox[
|
|
|
|
ButtonBox[
|
|
|
|
TooltipBox[
|
|
|
|
GraphicsBox[{{
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{0, 0}]}, {
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{1, -1}]}, {
|
|
|
|
RGBColor[1, 0, 0],
|
|
|
|
RectangleBox[{0, -1}, {2, 1}]}}, DefaultBaseStyle ->
|
|
|
|
"ColorSwatchGraphics", AspectRatio -> 1, Frame -> True,
|
|
|
|
FrameStyle -> RGBColor[0.6666666666666666, 0., 0.],
|
|
|
|
FrameTicks -> None, PlotRangePadding -> None, ImageSize ->
|
|
|
|
Dynamic[{
|
|
|
|
Automatic, 1.35 CurrentValue["FontCapHeight"]/
|
|
|
|
AbsoluteCurrentValue[Magnification]}]],
|
|
|
|
StyleBox[
|
|
|
|
RowBox[{"RGBColor", "[",
|
|
|
|
RowBox[{"1", ",", "0", ",", "0"}], "]"}], NumberMarks ->
|
|
|
|
False]], Appearance -> None, BaseStyle -> {},
|
|
|
|
BaselinePosition -> Baseline, DefaultBaseStyle -> {},
|
|
|
|
ButtonFunction :> With[{Typeset`box$ = EvaluationBox[]},
|
|
|
|
If[
|
|
|
|
Not[
|
|
|
|
AbsoluteCurrentValue["Deployed"]],
|
|
|
|
SelectionMove[Typeset`box$, All, Expression];
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialAlpha = 1;
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialColor =
|
|
|
|
RGBColor[1, 0, 0];
|
|
|
|
FrontEnd`Private`$ColorSelectorUseMakeBoxes = True;
|
|
|
|
MathLink`CallFrontEnd[
|
|
|
|
FrontEnd`AttachCell[Typeset`box$,
|
|
|
|
FrontEndResource["RGBColorValueSelector"], {
|
|
|
|
0, {Left, Bottom}}, {Left, Top},
|
|
|
|
"ClosingActions" -> {
|
|
|
|
"SelectionDeparture", "ParentChanged",
|
|
|
|
"EvaluatorQuit"}]]]], BaseStyle -> Inherited, Evaluator ->
|
|
|
|
Automatic, Method -> "Preemptive"],
|
|
|
|
RGBColor[1, 0, 0], Editable -> False, Selectable ->
|
|
|
|
False]}], "]"}], ",",
|
2022-02-23 12:05:42 +01:00
|
|
|
RowBox[{"Directive", "[",
|
|
|
|
RowBox[{
|
|
|
|
RowBox[{"PointSize", "[", "0.009166666666666668`", "]"}],
|
|
|
|
",",
|
|
|
|
RowBox[{"CapForm", "[", "\"Butt\"", "]"}], ",",
|
|
|
|
RowBox[{"AbsoluteThickness", "[", "1.6`", "]"}], ",",
|
|
|
|
RowBox[{"Thickness", "[", "0.01`", "]"}], ",",
|
2022-04-21 16:23:20 +02:00
|
|
|
InterpretationBox[
|
|
|
|
ButtonBox[
|
|
|
|
TooltipBox[
|
|
|
|
GraphicsBox[{{
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{0, 0}]}, {
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{1, -1}]}, {
|
|
|
|
RGBColor[0, 0, 1],
|
|
|
|
RectangleBox[{0, -1}, {2, 1}]}}, DefaultBaseStyle ->
|
|
|
|
"ColorSwatchGraphics", AspectRatio -> 1, Frame -> True,
|
|
|
|
FrameStyle -> RGBColor[0., 0., 0.6666666666666666],
|
|
|
|
FrameTicks -> None, PlotRangePadding -> None, ImageSize ->
|
|
|
|
Dynamic[{
|
|
|
|
Automatic, 1.35 CurrentValue["FontCapHeight"]/
|
|
|
|
AbsoluteCurrentValue[Magnification]}]],
|
|
|
|
StyleBox[
|
|
|
|
RowBox[{"RGBColor", "[",
|
|
|
|
RowBox[{"0", ",", "0", ",", "1"}], "]"}], NumberMarks ->
|
|
|
|
False]], Appearance -> None, BaseStyle -> {},
|
|
|
|
BaselinePosition -> Baseline, DefaultBaseStyle -> {},
|
|
|
|
ButtonFunction :> With[{Typeset`box$ = EvaluationBox[]},
|
|
|
|
If[
|
|
|
|
Not[
|
|
|
|
AbsoluteCurrentValue["Deployed"]],
|
|
|
|
SelectionMove[Typeset`box$, All, Expression];
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialAlpha = 1;
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialColor =
|
|
|
|
RGBColor[0, 0, 1];
|
|
|
|
FrontEnd`Private`$ColorSelectorUseMakeBoxes = True;
|
|
|
|
MathLink`CallFrontEnd[
|
|
|
|
FrontEnd`AttachCell[Typeset`box$,
|
|
|
|
FrontEndResource["RGBColorValueSelector"], {
|
|
|
|
0, {Left, Bottom}}, {Left, Top},
|
|
|
|
"ClosingActions" -> {
|
|
|
|
"SelectionDeparture", "ParentChanged",
|
|
|
|
"EvaluatorQuit"}]]]], BaseStyle -> Inherited, Evaluator ->
|
|
|
|
Automatic, Method -> "Preemptive"],
|
|
|
|
RGBColor[0, 0, 1], Editable -> False, Selectable ->
|
|
|
|
False]}], "]"}], ",",
|
2022-02-23 12:05:42 +01:00
|
|
|
RowBox[{"Directive", "[",
|
|
|
|
RowBox[{
|
|
|
|
RowBox[{"PointSize", "[", "0.009166666666666668`", "]"}],
|
|
|
|
",",
|
|
|
|
RowBox[{"CapForm", "[", "\"Butt\"", "]"}], ",",
|
|
|
|
RowBox[{"AbsoluteThickness", "[", "1.6`", "]"}], ",",
|
|
|
|
RowBox[{"Thickness", "[", "0.01`", "]"}], ",",
|
2022-04-21 16:23:20 +02:00
|
|
|
InterpretationBox[
|
|
|
|
ButtonBox[
|
|
|
|
TooltipBox[
|
|
|
|
GraphicsBox[{{
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{0, 0}]}, {
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{1, -1}]}, {
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{0, -1}, {2, 1}]}}, DefaultBaseStyle ->
|
|
|
|
"ColorSwatchGraphics", AspectRatio -> 1, Frame -> True,
|
|
|
|
FrameStyle -> GrayLevel[0.], FrameTicks -> None,
|
|
|
|
PlotRangePadding -> None, ImageSize ->
|
|
|
|
Dynamic[{
|
|
|
|
Automatic, 1.35 CurrentValue["FontCapHeight"]/
|
|
|
|
AbsoluteCurrentValue[Magnification]}]],
|
|
|
|
StyleBox[
|
|
|
|
RowBox[{"GrayLevel", "[", "0", "]"}], NumberMarks ->
|
|
|
|
False]], Appearance -> None, BaseStyle -> {},
|
|
|
|
BaselinePosition -> Baseline, DefaultBaseStyle -> {},
|
|
|
|
ButtonFunction :> With[{Typeset`box$ = EvaluationBox[]},
|
|
|
|
If[
|
|
|
|
Not[
|
|
|
|
AbsoluteCurrentValue["Deployed"]],
|
|
|
|
SelectionMove[Typeset`box$, All, Expression];
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialAlpha = 1;
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialColor =
|
|
|
|
GrayLevel[0];
|
|
|
|
FrontEnd`Private`$ColorSelectorUseMakeBoxes = True;
|
|
|
|
MathLink`CallFrontEnd[
|
|
|
|
FrontEnd`AttachCell[Typeset`box$,
|
|
|
|
FrontEndResource["GrayLevelColorValueSelector"], {
|
|
|
|
0, {Left, Bottom}}, {Left, Top},
|
|
|
|
"ClosingActions" -> {
|
|
|
|
"SelectionDeparture", "ParentChanged",
|
|
|
|
"EvaluatorQuit"}]]]], BaseStyle -> Inherited, Evaluator ->
|
|
|
|
Automatic, Method -> "Preemptive"],
|
|
|
|
GrayLevel[0], Editable -> False, Selectable -> False]}],
|
|
|
|
"]"}], ",",
|
2022-02-23 12:05:42 +01:00
|
|
|
RowBox[{"Directive", "[",
|
|
|
|
RowBox[{
|
|
|
|
RowBox[{"PointSize", "[", "0.009166666666666668`", "]"}],
|
|
|
|
",",
|
|
|
|
RowBox[{"CapForm", "[", "\"Butt\"", "]"}], ",",
|
|
|
|
RowBox[{"AbsoluteThickness", "[", "1.6`", "]"}], ",",
|
|
|
|
RowBox[{"Thickness", "[", "0.01`", "]"}], ",",
|
2022-04-21 16:23:20 +02:00
|
|
|
InterpretationBox[
|
|
|
|
ButtonBox[
|
|
|
|
TooltipBox[
|
|
|
|
GraphicsBox[{{
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{0, 0}]}, {
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{1, -1}]}, {
|
|
|
|
GrayLevel[0.5],
|
|
|
|
RectangleBox[{0, -1}, {2, 1}]}}, DefaultBaseStyle ->
|
|
|
|
"ColorSwatchGraphics", AspectRatio -> 1, Frame -> True,
|
|
|
|
FrameStyle -> GrayLevel[0.33333333333333337`], FrameTicks ->
|
|
|
|
None, PlotRangePadding -> None, ImageSize ->
|
|
|
|
Dynamic[{
|
|
|
|
Automatic, 1.35 CurrentValue["FontCapHeight"]/
|
|
|
|
AbsoluteCurrentValue[Magnification]}]],
|
|
|
|
StyleBox[
|
|
|
|
RowBox[{"GrayLevel", "[", "0.5`", "]"}], NumberMarks ->
|
|
|
|
False]], Appearance -> None, BaseStyle -> {},
|
|
|
|
BaselinePosition -> Baseline, DefaultBaseStyle -> {},
|
|
|
|
ButtonFunction :> With[{Typeset`box$ = EvaluationBox[]},
|
|
|
|
If[
|
|
|
|
Not[
|
|
|
|
AbsoluteCurrentValue["Deployed"]],
|
|
|
|
SelectionMove[Typeset`box$, All, Expression];
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialAlpha = 1;
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialColor =
|
|
|
|
GrayLevel[0.5];
|
|
|
|
FrontEnd`Private`$ColorSelectorUseMakeBoxes = True;
|
|
|
|
MathLink`CallFrontEnd[
|
|
|
|
FrontEnd`AttachCell[Typeset`box$,
|
|
|
|
FrontEndResource["GrayLevelColorValueSelector"], {
|
|
|
|
0, {Left, Bottom}}, {Left, Top},
|
|
|
|
"ClosingActions" -> {
|
|
|
|
"SelectionDeparture", "ParentChanged",
|
|
|
|
"EvaluatorQuit"}]]]], BaseStyle -> Inherited, Evaluator ->
|
|
|
|
Automatic, Method -> "Preemptive"],
|
|
|
|
GrayLevel[0.5], Editable -> False, Selectable -> False]}],
|
|
|
|
"]"}]}], "}"}], ",",
|
2022-02-23 12:05:42 +01:00
|
|
|
RowBox[{"{",
|
|
|
|
RowBox[{#, ",", #2, ",", #3, ",", #4, ",", #5}], "}"}], ",",
|
|
|
|
RowBox[{"LegendMarkers", "\[Rule]",
|
|
|
|
RowBox[{"{",
|
|
|
|
RowBox[{
|
|
|
|
RowBox[{"{",
|
|
|
|
RowBox[{"False", ",", "Automatic"}], "}"}], ",",
|
|
|
|
RowBox[{"{",
|
|
|
|
RowBox[{"False", ",", "Automatic"}], "}"}], ",",
|
|
|
|
RowBox[{"{",
|
|
|
|
RowBox[{"False", ",", "Automatic"}], "}"}], ",",
|
|
|
|
RowBox[{"{",
|
|
|
|
RowBox[{"False", ",", "Automatic"}], "}"}], ",",
|
|
|
|
RowBox[{"{",
|
|
|
|
RowBox[{"False", ",", "Automatic"}], "}"}]}], "}"}]}], ",",
|
|
|
|
RowBox[{"Joined", "\[Rule]",
|
|
|
|
RowBox[{"{",
|
|
|
|
|
|
|
|
RowBox[{
|
|
|
|
"True", ",", "True", ",", "True", ",", "True", ",", "True"}],
|
|
|
|
"}"}]}], ",",
|
|
|
|
RowBox[{"LabelStyle", "\[Rule]",
|
|
|
|
RowBox[{"{",
|
|
|
|
RowBox[{"FontFamily", "\[Rule]", "\"Times\""}], "}"}]}], ",",
|
|
|
|
RowBox[{"LegendLayout", "\[Rule]", "\"Column\""}]}], "]"}]& )],
|
|
|
|
Scaled[{0.99, 0.99}], ImageScaled[{1, 1}],
|
|
|
|
BaseStyle->{FontSize -> Larger},
|
|
|
|
FormatType->StandardForm]},
|
|
|
|
AspectRatio->1,
|
|
|
|
Axes->{False, False},
|
|
|
|
AxesLabel->{None, None},
|
2022-04-21 16:23:20 +02:00
|
|
|
AxesOrigin->{1.1, -199.},
|
2022-02-23 12:05:42 +01:00
|
|
|
BaseStyle->18,
|
|
|
|
DisplayFunction->Identity,
|
|
|
|
Frame->{{True, True}, {True, True}},
|
|
|
|
FrameLabel->{{
|
|
|
|
FormBox[
|
|
|
|
StyleBox[
|
|
|
|
"\"\\!\\(\\*StyleBox[\\\"E\\\",FontSlant->\\\"Italic\\\"]\\)(F-F) \
|
|
|
|
(hartree)\"", FontSize -> 20, StripOnInput -> False], TraditionalForm],
|
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|
|
FrontEnd`Private`$ColorSelectorUseMakeBoxes = True;
|
|
|
|
MathLink`CallFrontEnd[
|
|
|
|
FrontEnd`AttachCell[Typeset`box$,
|
|
|
|
FrontEndResource["RGBColorValueSelector"], {
|
|
|
|
0, {Left, Bottom}}, {Left, Top},
|
|
|
|
"ClosingActions" -> {
|
|
|
|
"SelectionDeparture", "ParentChanged",
|
|
|
|
"EvaluatorQuit"}]]]], BaseStyle -> Inherited, Evaluator ->
|
|
|
|
Automatic, Method -> "Preemptive"],
|
|
|
|
RGBColor[1, 0.5, 0], Editable -> False, Selectable ->
|
|
|
|
False]}], "]"}], ",",
|
|
|
|
RowBox[{"Directive", "[",
|
|
|
|
RowBox[{
|
|
|
|
RowBox[{"PointSize", "[", "0.009166666666666668`", "]"}],
|
|
|
|
",",
|
|
|
|
RowBox[{"CapForm", "[", "\"Butt\"", "]"}], ",",
|
|
|
|
RowBox[{"AbsoluteThickness", "[", "1.6`", "]"}], ",",
|
|
|
|
RowBox[{"Thickness", "[", "0.01`", "]"}], ",",
|
|
|
|
InterpretationBox[
|
|
|
|
ButtonBox[
|
|
|
|
TooltipBox[
|
|
|
|
GraphicsBox[{{
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{0, 0}]}, {
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{1, -1}]}, {
|
|
|
|
RGBColor[1, 0, 0],
|
|
|
|
RectangleBox[{0, -1}, {2, 1}]}}, DefaultBaseStyle ->
|
|
|
|
"ColorSwatchGraphics", AspectRatio -> 1, Frame -> True,
|
|
|
|
FrameStyle -> RGBColor[0.6666666666666666, 0., 0.],
|
|
|
|
FrameTicks -> None, PlotRangePadding -> None, ImageSize ->
|
|
|
|
Dynamic[{
|
|
|
|
Automatic, 1.35 CurrentValue["FontCapHeight"]/
|
|
|
|
AbsoluteCurrentValue[Magnification]}]],
|
|
|
|
StyleBox[
|
|
|
|
RowBox[{"RGBColor", "[",
|
|
|
|
RowBox[{"1", ",", "0", ",", "0"}], "]"}], NumberMarks ->
|
|
|
|
False]], Appearance -> None, BaseStyle -> {},
|
|
|
|
BaselinePosition -> Baseline, DefaultBaseStyle -> {},
|
|
|
|
ButtonFunction :> With[{Typeset`box$ = EvaluationBox[]},
|
|
|
|
If[
|
|
|
|
Not[
|
|
|
|
AbsoluteCurrentValue["Deployed"]],
|
|
|
|
SelectionMove[Typeset`box$, All, Expression];
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialAlpha = 1;
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialColor =
|
|
|
|
RGBColor[1, 0, 0];
|
|
|
|
FrontEnd`Private`$ColorSelectorUseMakeBoxes = True;
|
|
|
|
MathLink`CallFrontEnd[
|
|
|
|
FrontEnd`AttachCell[Typeset`box$,
|
|
|
|
FrontEndResource["RGBColorValueSelector"], {
|
|
|
|
0, {Left, Bottom}}, {Left, Top},
|
|
|
|
"ClosingActions" -> {
|
|
|
|
"SelectionDeparture", "ParentChanged",
|
|
|
|
"EvaluatorQuit"}]]]], BaseStyle -> Inherited, Evaluator ->
|
|
|
|
Automatic, Method -> "Preemptive"],
|
|
|
|
RGBColor[1, 0, 0], Editable -> False, Selectable ->
|
|
|
|
False]}], "]"}], ",",
|
|
|
|
RowBox[{"Directive", "[",
|
|
|
|
RowBox[{
|
|
|
|
RowBox[{"PointSize", "[", "0.009166666666666668`", "]"}],
|
|
|
|
",",
|
|
|
|
RowBox[{"CapForm", "[", "\"Butt\"", "]"}], ",",
|
|
|
|
RowBox[{"AbsoluteThickness", "[", "1.6`", "]"}], ",",
|
|
|
|
RowBox[{"Thickness", "[", "0.01`", "]"}], ",",
|
|
|
|
InterpretationBox[
|
|
|
|
ButtonBox[
|
|
|
|
TooltipBox[
|
|
|
|
GraphicsBox[{{
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{0, 0}]}, {
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{1, -1}]}, {
|
|
|
|
RGBColor[0, 0, 1],
|
|
|
|
RectangleBox[{0, -1}, {2, 1}]}}, DefaultBaseStyle ->
|
|
|
|
"ColorSwatchGraphics", AspectRatio -> 1, Frame -> True,
|
|
|
|
FrameStyle -> RGBColor[0., 0., 0.6666666666666666],
|
|
|
|
FrameTicks -> None, PlotRangePadding -> None, ImageSize ->
|
|
|
|
Dynamic[{
|
|
|
|
Automatic, 1.35 CurrentValue["FontCapHeight"]/
|
|
|
|
AbsoluteCurrentValue[Magnification]}]],
|
|
|
|
StyleBox[
|
|
|
|
RowBox[{"RGBColor", "[",
|
|
|
|
RowBox[{"0", ",", "0", ",", "1"}], "]"}], NumberMarks ->
|
|
|
|
False]], Appearance -> None, BaseStyle -> {},
|
|
|
|
BaselinePosition -> Baseline, DefaultBaseStyle -> {},
|
|
|
|
ButtonFunction :> With[{Typeset`box$ = EvaluationBox[]},
|
|
|
|
If[
|
|
|
|
Not[
|
|
|
|
AbsoluteCurrentValue["Deployed"]],
|
|
|
|
SelectionMove[Typeset`box$, All, Expression];
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialAlpha = 1;
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialColor =
|
|
|
|
RGBColor[0, 0, 1];
|
|
|
|
FrontEnd`Private`$ColorSelectorUseMakeBoxes = True;
|
|
|
|
MathLink`CallFrontEnd[
|
|
|
|
FrontEnd`AttachCell[Typeset`box$,
|
|
|
|
FrontEndResource["RGBColorValueSelector"], {
|
|
|
|
0, {Left, Bottom}}, {Left, Top},
|
|
|
|
"ClosingActions" -> {
|
|
|
|
"SelectionDeparture", "ParentChanged",
|
|
|
|
"EvaluatorQuit"}]]]], BaseStyle -> Inherited, Evaluator ->
|
|
|
|
Automatic, Method -> "Preemptive"],
|
|
|
|
RGBColor[0, 0, 1], Editable -> False, Selectable ->
|
|
|
|
False]}], "]"}], ",",
|
|
|
|
RowBox[{"Directive", "[",
|
|
|
|
RowBox[{
|
|
|
|
RowBox[{"PointSize", "[", "0.009166666666666668`", "]"}],
|
|
|
|
",",
|
|
|
|
RowBox[{"CapForm", "[", "\"Butt\"", "]"}], ",",
|
|
|
|
RowBox[{"AbsoluteThickness", "[", "1.6`", "]"}], ",",
|
|
|
|
RowBox[{"Thickness", "[", "0.01`", "]"}], ",",
|
|
|
|
InterpretationBox[
|
|
|
|
ButtonBox[
|
|
|
|
TooltipBox[
|
|
|
|
GraphicsBox[{{
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{0, 0}]}, {
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{1, -1}]}, {
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{0, -1}, {2, 1}]}}, DefaultBaseStyle ->
|
|
|
|
"ColorSwatchGraphics", AspectRatio -> 1, Frame -> True,
|
|
|
|
FrameStyle -> GrayLevel[0.], FrameTicks -> None,
|
|
|
|
PlotRangePadding -> None, ImageSize ->
|
|
|
|
Dynamic[{
|
|
|
|
Automatic, 1.35 CurrentValue["FontCapHeight"]/
|
|
|
|
AbsoluteCurrentValue[Magnification]}]],
|
|
|
|
StyleBox[
|
|
|
|
RowBox[{"GrayLevel", "[", "0", "]"}], NumberMarks ->
|
|
|
|
False]], Appearance -> None, BaseStyle -> {},
|
|
|
|
BaselinePosition -> Baseline, DefaultBaseStyle -> {},
|
|
|
|
ButtonFunction :> With[{Typeset`box$ = EvaluationBox[]},
|
|
|
|
If[
|
|
|
|
Not[
|
|
|
|
AbsoluteCurrentValue["Deployed"]],
|
|
|
|
SelectionMove[Typeset`box$, All, Expression];
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialAlpha = 1;
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialColor =
|
|
|
|
GrayLevel[0];
|
|
|
|
FrontEnd`Private`$ColorSelectorUseMakeBoxes = True;
|
|
|
|
MathLink`CallFrontEnd[
|
|
|
|
FrontEnd`AttachCell[Typeset`box$,
|
|
|
|
FrontEndResource["GrayLevelColorValueSelector"], {
|
|
|
|
0, {Left, Bottom}}, {Left, Top},
|
|
|
|
"ClosingActions" -> {
|
|
|
|
"SelectionDeparture", "ParentChanged",
|
|
|
|
"EvaluatorQuit"}]]]], BaseStyle -> Inherited, Evaluator ->
|
|
|
|
Automatic, Method -> "Preemptive"],
|
|
|
|
GrayLevel[0], Editable -> False, Selectable -> False]}],
|
|
|
|
"]"}], ",",
|
|
|
|
RowBox[{"Directive", "[",
|
|
|
|
RowBox[{
|
|
|
|
RowBox[{"PointSize", "[", "0.009166666666666668`", "]"}],
|
|
|
|
",",
|
|
|
|
RowBox[{"CapForm", "[", "\"Butt\"", "]"}], ",",
|
|
|
|
RowBox[{"AbsoluteThickness", "[", "1.6`", "]"}], ",",
|
|
|
|
RowBox[{"Thickness", "[", "0.01`", "]"}], ",",
|
|
|
|
InterpretationBox[
|
|
|
|
ButtonBox[
|
|
|
|
TooltipBox[
|
|
|
|
GraphicsBox[{{
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{0, 0}]}, {
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{1, -1}]}, {
|
|
|
|
GrayLevel[0.5],
|
|
|
|
RectangleBox[{0, -1}, {2, 1}]}}, DefaultBaseStyle ->
|
|
|
|
"ColorSwatchGraphics", AspectRatio -> 1, Frame -> True,
|
|
|
|
FrameStyle -> GrayLevel[0.33333333333333337`], FrameTicks ->
|
|
|
|
None, PlotRangePadding -> None, ImageSize ->
|
|
|
|
Dynamic[{
|
|
|
|
Automatic, 1.35 CurrentValue["FontCapHeight"]/
|
|
|
|
AbsoluteCurrentValue[Magnification]}]],
|
|
|
|
StyleBox[
|
|
|
|
RowBox[{"GrayLevel", "[", "0.5`", "]"}], NumberMarks ->
|
|
|
|
False]], Appearance -> None, BaseStyle -> {},
|
|
|
|
BaselinePosition -> Baseline, DefaultBaseStyle -> {},
|
|
|
|
ButtonFunction :> With[{Typeset`box$ = EvaluationBox[]},
|
|
|
|
If[
|
|
|
|
Not[
|
|
|
|
AbsoluteCurrentValue["Deployed"]],
|
|
|
|
SelectionMove[Typeset`box$, All, Expression];
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialAlpha = 1;
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialColor =
|
|
|
|
GrayLevel[0.5];
|
|
|
|
FrontEnd`Private`$ColorSelectorUseMakeBoxes = True;
|
|
|
|
MathLink`CallFrontEnd[
|
|
|
|
FrontEnd`AttachCell[Typeset`box$,
|
|
|
|
FrontEndResource["GrayLevelColorValueSelector"], {
|
|
|
|
0, {Left, Bottom}}, {Left, Top},
|
|
|
|
"ClosingActions" -> {
|
|
|
|
"SelectionDeparture", "ParentChanged",
|
|
|
|
"EvaluatorQuit"}]]]], BaseStyle -> Inherited, Evaluator ->
|
|
|
|
Automatic, Method -> "Preemptive"],
|
|
|
|
GrayLevel[0.5], Editable -> False, Selectable -> False]}],
|
|
|
|
"]"}]}], "}"}], ",",
|
|
|
|
RowBox[{"{",
|
|
|
|
RowBox[{#, ",", #2, ",", #3, ",", #4, ",", #5}], "}"}], ",",
|
|
|
|
RowBox[{"LegendMarkers", "\[Rule]",
|
|
|
|
RowBox[{"{",
|
|
|
|
RowBox[{
|
|
|
|
RowBox[{"{",
|
|
|
|
RowBox[{"False", ",", "Automatic"}], "}"}], ",",
|
|
|
|
RowBox[{"{",
|
|
|
|
RowBox[{"False", ",", "Automatic"}], "}"}], ",",
|
|
|
|
RowBox[{"{",
|
|
|
|
RowBox[{"False", ",", "Automatic"}], "}"}], ",",
|
|
|
|
RowBox[{"{",
|
|
|
|
RowBox[{"False", ",", "Automatic"}], "}"}], ",",
|
|
|
|
RowBox[{"{",
|
|
|
|
RowBox[{"False", ",", "Automatic"}], "}"}]}], "}"}]}], ",",
|
|
|
|
RowBox[{"Joined", "\[Rule]",
|
|
|
|
RowBox[{"{",
|
|
|
|
|
|
|
|
RowBox[{
|
|
|
|
"True", ",", "True", ",", "True", ",", "True", ",", "True"}],
|
|
|
|
"}"}]}], ",",
|
|
|
|
RowBox[{"LabelStyle", "\[Rule]",
|
|
|
|
RowBox[{"{",
|
|
|
|
RowBox[{"FontFamily", "\[Rule]", "\"Times\""}], "}"}]}], ",",
|
|
|
|
RowBox[{"LegendLayout", "\[Rule]", "\"Column\""}]}], "]"}]& )],
|
|
|
|
Scaled[{0.99, 0.99}], ImageScaled[{1, 1}],
|
|
|
|
BaseStyle->{FontSize -> Larger},
|
|
|
|
FormatType->StandardForm]},
|
|
|
|
AspectRatio->1,
|
|
|
|
Axes->{False, False},
|
|
|
|
AxesLabel->{None, None},
|
|
|
|
AxesOrigin->{1.1, -199.},
|
|
|
|
BaseStyle->18,
|
|
|
|
DisplayFunction->Identity,
|
|
|
|
Frame->{{True, True}, {True, True}},
|
|
|
|
FrameLabel->{{
|
|
|
|
FormBox[
|
|
|
|
StyleBox[
|
|
|
|
"\"\\!\\(\\*StyleBox[\\\"E\\\",FontSlant->\\\"Italic\\\"]\\)(F-F) \
|
|
|
|
(hartree)\"", FontSize -> 20, StripOnInput -> False], TraditionalForm],
|
|
|
|
None}, {
|
|
|
|
FormBox[
|
|
|
|
StyleBox[
|
|
|
|
"\"\\!\\(\\*SubscriptBox[\\(R\\), \\(F - F\\)]\\) (\[Angstrom])\"",
|
|
|
|
FontSize -> 20, StripOnInput -> False], TraditionalForm], None}},
|
|
|
|
FrameStyle->Automatic,
|
|
|
|
FrameTicks->{{Automatic, Automatic}, {Automatic, Automatic}},
|
|
|
|
GridLines->{Automatic, Automatic},
|
|
|
|
GridLinesStyle->Directive[
|
|
|
|
GrayLevel[0.5, 0.4]],
|
|
|
|
ImageSize->500,
|
|
|
|
LabelStyle->{FontFamily -> "Times"},
|
|
|
|
Method->{
|
|
|
|
"OptimizePlotMarkers" -> True, "OptimizePlotMarkers" -> True,
|
|
|
|
"CoordinatesToolOptions" -> {"DisplayFunction" -> ({
|
|
|
|
Identity[
|
|
|
|
Part[#, 1]],
|
|
|
|
Identity[
|
|
|
|
Part[#, 2]]}& ), "CopiedValueFunction" -> ({
|
|
|
|
Identity[
|
|
|
|
Part[#, 1]],
|
|
|
|
Identity[
|
|
|
|
Part[#, 2]]}& )}},
|
2022-04-25 14:17:16 +02:00
|
|
|
PlotRange->{{1.1, 1.65}, {-199.125, -199}},
|
2022-04-21 16:23:20 +02:00
|
|
|
PlotRangeClipping->True,
|
|
|
|
PlotRangePadding->{{0, 0}, {0, 0}},
|
|
|
|
Ticks->{Automatic, Automatic}],
|
|
|
|
InterpretTemplate[Legended[
|
|
|
|
Graphics[{{}, {{{}, {}, {
|
|
|
|
Hue[0.67, 0.6, 0.6],
|
|
|
|
Directive[
|
|
|
|
PointSize[0.009166666666666668],
|
|
|
|
CapForm["Butt"],
|
|
|
|
AbsoluteThickness[1.6],
|
|
|
|
Thickness[0.01],
|
|
|
|
RGBColor[1, 0.5, 0]],
|
2022-04-25 14:17:16 +02:00
|
|
|
Line[{{1.1186000920834196`, -199.}, {1.16419, -199.0388640823}, {
|
|
|
|
1.21711, -199.0692686079}, {1.27002, -199.0889640392}, {
|
|
|
|
1.32294, -199.1009044038}, {1.37586, -199.1072986871}, {
|
|
|
|
1.42878, -199.1097975546}, {1.4817, -199.1096214147}, {
|
|
|
|
1.53461, -199.1076633248}, {1.58753, -199.1045747396}, {
|
|
|
|
1.64045, -199.1008324508}, {1.69337, -199.0967858098}, {
|
|
|
|
1.74628, -199.0926887251}}]}, {
|
2022-04-21 16:23:20 +02:00
|
|
|
Hue[0.9060679774997897, 0.6, 0.6],
|
|
|
|
Directive[
|
|
|
|
PointSize[0.009166666666666668],
|
|
|
|
CapForm["Butt"],
|
|
|
|
AbsoluteThickness[1.6],
|
|
|
|
Thickness[0.01],
|
|
|
|
RGBColor[1, 0, 0]],
|
2022-04-25 14:17:16 +02:00
|
|
|
Line[{{1.1246157483711674`, -199.}, {1.16419, -199.0333451097}, {
|
|
|
|
1.21711, -199.0631340935}, {1.27002, -199.082113329}, {
|
|
|
|
1.32294, -199.0932285028}, {1.37586, -199.0986805911}, {
|
|
|
|
1.42878, -199.1001132928}, {1.4817, -199.0987420273}, {
|
|
|
|
1.53461, -199.095457527}, {1.58753, -199.090912857}, {
|
|
|
|
1.64045, -199.0855910885}, {1.69337, -199.0798534114}, {
|
|
|
|
1.74628, -199.073970804}}]}, {
|
2022-04-21 16:23:20 +02:00
|
|
|
Hue[0.1421359549995791, 0.6, 0.6],
|
|
|
|
Directive[
|
|
|
|
PointSize[0.009166666666666668],
|
|
|
|
CapForm["Butt"],
|
|
|
|
AbsoluteThickness[1.6],
|
|
|
|
Thickness[0.01],
|
|
|
|
RGBColor[0, 0, 1]],
|
|
|
|
Line[CompressedData["
|
2022-04-25 14:17:16 +02:00
|
|
|
1:eJxTTMoPSmViYGAQB2IQHaLB1XH/zEd7BhB4kHEATDN8si8wVJ6ZCuSngcEn
|
|
|
|
e0+BtDbBhxkHzp4BgU/219JPX1kD5BuDwWf7sse8p9UfZRyYNRMEPttzTih8
|
|
|
|
2PkIZt4X+4uVOf43H8HM+2Iv+MOmUPgxzLwv9oFuG1V8H8PM+2qfGBLsU/oY
|
|
|
|
Zt5X+01JiaJdj2HmfbPncVdOnfwYZt43ex0WkfOL4OZ9s783KU9mA9y87/bb
|
|
|
|
JiTzbYKb991ePYWVdx3cvB/27NVREsvg5v2wX6agGjkZbt4P+/lT9n9rhJv3
|
|
|
|
03428+OUbLh5P+1PFTvsCYWb98v+rvpzVzu4eb/sV16/ul0eyAcAl5ux3w==
|
|
|
|
|
2022-04-21 16:23:20 +02:00
|
|
|
"]]}, {
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3k97GfOvW64+gpn3097LJcl1B9y/v+xvt7KpzIT795d9irTh0gq4f3/Z28lq
|
|
|
|
C4fDzfttz6rEuMEEyAcAViHDzA==
|
2022-04-21 16:23:20 +02:00
|
|
|
"]]}}, {{}, {}}}, InsetBox[
|
|
|
|
TemplateBox[{
|
|
|
|
StyleBox["\"CC3\"", FontSize -> 20, StripOnInput -> False],
|
|
|
|
StyleBox["\"CCSD\"", FontSize -> 20, StripOnInput -> False],
|
|
|
|
StyleBox[
|
|
|
|
"\"BSE@\\!\\(\\*SubscriptBox[\\(G\\), \
|
2022-04-25 14:17:16 +02:00
|
|
|
\\(0\\)]\\)\\!\\(\\*SubscriptBox[\\(W\\), \\(0\\)]\\)@HF (\[Eta] = 0 au)\"",
|
|
|
|
FontSize -> 20, StripOnInput -> False],
|
2022-04-21 16:23:20 +02:00
|
|
|
StyleBox[
|
|
|
|
"\"BSE@\\!\\(\\*SubscriptBox[\\(G\\), \
|
2022-04-25 14:17:16 +02:00
|
|
|
\\(0\\)]\\)\\!\\(\\*SubscriptBox[\\(W\\), \\(0\\)]\\)@HF (\[Eta] = 1 au)\"",
|
2022-04-21 16:23:20 +02:00
|
|
|
FontSize -> 20, StripOnInput -> False],
|
|
|
|
StyleBox[
|
2022-04-25 14:17:16 +02:00
|
|
|
"\"BSE@evGW@HF (\[Eta] = 1 au)\"", FontSize -> 20, StripOnInput ->
|
2022-04-21 16:23:20 +02:00
|
|
|
False]},
|
|
|
|
"PointLegend",
|
|
|
|
DisplayFunction->(FormBox[
|
|
|
|
StyleBox[
|
|
|
|
StyleBox[
|
|
|
|
PaneBox[
|
|
|
|
TagBox[
|
|
|
|
GridBox[{{
|
|
|
|
TagBox[
|
|
|
|
GridBox[{{
|
|
|
|
GraphicsBox[{{
|
|
|
|
Directive[
|
|
|
|
EdgeForm[
|
|
|
|
Directive[
|
|
|
|
Opacity[0.3],
|
|
|
|
GrayLevel[0]]],
|
|
|
|
PointSize[0.5],
|
|
|
|
CapForm["Butt"],
|
|
|
|
AbsoluteThickness[1.6],
|
|
|
|
Thickness[0.18],
|
|
|
|
RGBColor[1, 0.5, 0]], {
|
|
|
|
LineBox[{{0, 10}, {20, 10}}]}}, {
|
|
|
|
Directive[
|
|
|
|
EdgeForm[
|
|
|
|
Directive[
|
|
|
|
Opacity[0.3],
|
|
|
|
GrayLevel[0]]],
|
|
|
|
PointSize[0.5],
|
|
|
|
CapForm["Butt"],
|
|
|
|
AbsoluteThickness[1.6],
|
|
|
|
Thickness[0.18],
|
|
|
|
RGBColor[1, 0.5, 0]], {}}}, AspectRatio -> Full,
|
|
|
|
ImageSize -> {20, 10}, PlotRangePadding -> None,
|
|
|
|
ImagePadding -> Automatic,
|
|
|
|
BaselinePosition -> (Scaled[0.1] -> Baseline)], #}, {
|
|
|
|
GraphicsBox[{{
|
|
|
|
Directive[
|
|
|
|
EdgeForm[
|
|
|
|
Directive[
|
|
|
|
Opacity[0.3],
|
|
|
|
GrayLevel[0]]],
|
|
|
|
PointSize[0.5],
|
|
|
|
CapForm["Butt"],
|
|
|
|
AbsoluteThickness[1.6],
|
|
|
|
Thickness[0.18],
|
|
|
|
RGBColor[1, 0, 0]], {
|
|
|
|
LineBox[{{0, 10}, {20, 10}}]}}, {
|
|
|
|
Directive[
|
|
|
|
EdgeForm[
|
|
|
|
Directive[
|
|
|
|
Opacity[0.3],
|
|
|
|
GrayLevel[0]]],
|
|
|
|
PointSize[0.5],
|
|
|
|
CapForm["Butt"],
|
|
|
|
AbsoluteThickness[1.6],
|
|
|
|
Thickness[0.18],
|
|
|
|
RGBColor[1, 0, 0]], {}}}, AspectRatio -> Full,
|
|
|
|
ImageSize -> {20, 10}, PlotRangePadding -> None,
|
|
|
|
ImagePadding -> Automatic,
|
|
|
|
BaselinePosition -> (Scaled[0.1] -> Baseline)], #2}, {
|
|
|
|
GraphicsBox[{{
|
|
|
|
Directive[
|
|
|
|
EdgeForm[
|
|
|
|
Directive[
|
|
|
|
Opacity[0.3],
|
|
|
|
GrayLevel[0]]],
|
|
|
|
PointSize[0.5],
|
|
|
|
CapForm["Butt"],
|
|
|
|
AbsoluteThickness[1.6],
|
|
|
|
Thickness[0.18],
|
|
|
|
RGBColor[0, 0, 1]], {
|
|
|
|
LineBox[{{0, 10}, {20, 10}}]}}, {
|
|
|
|
Directive[
|
|
|
|
EdgeForm[
|
|
|
|
Directive[
|
|
|
|
Opacity[0.3],
|
|
|
|
GrayLevel[0]]],
|
|
|
|
PointSize[0.5],
|
|
|
|
CapForm["Butt"],
|
|
|
|
AbsoluteThickness[1.6],
|
|
|
|
Thickness[0.18],
|
|
|
|
RGBColor[0, 0, 1]], {}}}, AspectRatio -> Full,
|
|
|
|
ImageSize -> {20, 10}, PlotRangePadding -> None,
|
|
|
|
ImagePadding -> Automatic,
|
|
|
|
BaselinePosition -> (Scaled[0.1] -> Baseline)], #3}, {
|
|
|
|
GraphicsBox[{{
|
|
|
|
Directive[
|
|
|
|
EdgeForm[
|
|
|
|
Directive[
|
|
|
|
Opacity[0.3],
|
|
|
|
GrayLevel[0]]],
|
|
|
|
PointSize[0.5],
|
|
|
|
CapForm["Butt"],
|
|
|
|
AbsoluteThickness[1.6],
|
|
|
|
Thickness[0.18],
|
|
|
|
GrayLevel[0]], {
|
|
|
|
LineBox[{{0, 10}, {20, 10}}]}}, {
|
|
|
|
Directive[
|
|
|
|
EdgeForm[
|
|
|
|
Directive[
|
|
|
|
Opacity[0.3],
|
|
|
|
GrayLevel[0]]],
|
|
|
|
PointSize[0.5],
|
|
|
|
CapForm["Butt"],
|
|
|
|
AbsoluteThickness[1.6],
|
|
|
|
Thickness[0.18],
|
|
|
|
GrayLevel[0]], {}}}, AspectRatio -> Full,
|
|
|
|
ImageSize -> {20, 10}, PlotRangePadding -> None,
|
|
|
|
ImagePadding -> Automatic,
|
|
|
|
BaselinePosition -> (Scaled[0.1] -> Baseline)], #4}, {
|
|
|
|
GraphicsBox[{{
|
|
|
|
Directive[
|
|
|
|
EdgeForm[
|
|
|
|
Directive[
|
|
|
|
Opacity[0.3],
|
|
|
|
GrayLevel[0]]],
|
|
|
|
PointSize[0.5],
|
|
|
|
CapForm["Butt"],
|
|
|
|
AbsoluteThickness[1.6],
|
|
|
|
Thickness[0.18],
|
|
|
|
GrayLevel[0.5]], {
|
|
|
|
LineBox[{{0, 10}, {20, 10}}]}}, {
|
|
|
|
Directive[
|
|
|
|
EdgeForm[
|
|
|
|
Directive[
|
|
|
|
Opacity[0.3],
|
|
|
|
GrayLevel[0]]],
|
|
|
|
PointSize[0.5],
|
|
|
|
CapForm["Butt"],
|
|
|
|
AbsoluteThickness[1.6],
|
|
|
|
Thickness[0.18],
|
|
|
|
GrayLevel[0.5]], {}}}, AspectRatio -> Full,
|
|
|
|
ImageSize -> {20, 10}, PlotRangePadding -> None,
|
|
|
|
ImagePadding -> Automatic,
|
|
|
|
BaselinePosition -> (Scaled[0.1] -> Baseline)], #5}},
|
|
|
|
GridBoxAlignment -> {
|
|
|
|
"Columns" -> {Center, Left}, "Rows" -> {{Baseline}}},
|
|
|
|
AutoDelete -> False,
|
|
|
|
GridBoxDividers -> {
|
|
|
|
"Columns" -> {{False}}, "Rows" -> {{False}}},
|
|
|
|
GridBoxItemSize -> {"Columns" -> {{All}}, "Rows" -> {{All}}},
|
|
|
|
GridBoxSpacings -> {
|
|
|
|
"Columns" -> {{0.5}}, "Rows" -> {{0.8}}}], "Grid"]}},
|
|
|
|
GridBoxAlignment -> {"Columns" -> {{Left}}, "Rows" -> {{Top}}},
|
|
|
|
AutoDelete -> False,
|
|
|
|
GridBoxItemSize -> {
|
|
|
|
"Columns" -> {{Automatic}}, "Rows" -> {{Automatic}}},
|
|
|
|
GridBoxSpacings -> {"Columns" -> {{1}}, "Rows" -> {{0}}}],
|
|
|
|
"Grid"], Alignment -> Left, AppearanceElements -> None,
|
|
|
|
ImageMargins -> {{5, 5}, {5, 5}}, ImageSizeAction ->
|
|
|
|
"ResizeToFit"], LineIndent -> 0, StripOnInput -> False], {
|
|
|
|
FontFamily -> "Times"}, Background -> Automatic, StripOnInput ->
|
|
|
|
False], TraditionalForm]& ),
|
|
|
|
Editable->True,
|
|
|
|
InterpretationFunction:>(RowBox[{"PointLegend", "[",
|
|
|
|
RowBox[{
|
|
|
|
RowBox[{"{",
|
|
|
|
RowBox[{
|
|
|
|
RowBox[{"Directive", "[",
|
|
|
|
RowBox[{
|
|
|
|
RowBox[{"PointSize", "[", "0.009166666666666668`", "]"}],
|
|
|
|
",",
|
|
|
|
RowBox[{"CapForm", "[", "\"Butt\"", "]"}], ",",
|
|
|
|
RowBox[{"AbsoluteThickness", "[", "1.6`", "]"}], ",",
|
|
|
|
RowBox[{"Thickness", "[", "0.01`", "]"}], ",",
|
|
|
|
InterpretationBox[
|
|
|
|
ButtonBox[
|
|
|
|
TooltipBox[
|
|
|
|
GraphicsBox[{{
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{0, 0}]}, {
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{1, -1}]}, {
|
|
|
|
RGBColor[1, 0.5, 0],
|
|
|
|
RectangleBox[{0, -1}, {2, 1}]}}, DefaultBaseStyle ->
|
|
|
|
"ColorSwatchGraphics", AspectRatio -> 1, Frame -> True,
|
|
|
|
FrameStyle ->
|
|
|
|
RGBColor[0.6666666666666666, 0.33333333333333337`, 0.],
|
|
|
|
FrameTicks -> None, PlotRangePadding -> None, ImageSize ->
|
|
|
|
Dynamic[{
|
|
|
|
Automatic, 1.35 CurrentValue["FontCapHeight"]/
|
|
|
|
AbsoluteCurrentValue[Magnification]}]],
|
|
|
|
StyleBox[
|
|
|
|
RowBox[{"RGBColor", "[",
|
|
|
|
RowBox[{"1", ",", "0.5`", ",", "0"}], "]"}], NumberMarks ->
|
|
|
|
False]], Appearance -> None, BaseStyle -> {},
|
|
|
|
BaselinePosition -> Baseline, DefaultBaseStyle -> {},
|
|
|
|
ButtonFunction :> With[{Typeset`box$ = EvaluationBox[]},
|
|
|
|
If[
|
|
|
|
Not[
|
|
|
|
AbsoluteCurrentValue["Deployed"]],
|
|
|
|
SelectionMove[Typeset`box$, All, Expression];
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialAlpha = 1;
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialColor =
|
|
|
|
RGBColor[1, 0.5, 0];
|
|
|
|
FrontEnd`Private`$ColorSelectorUseMakeBoxes = True;
|
|
|
|
MathLink`CallFrontEnd[
|
|
|
|
FrontEnd`AttachCell[Typeset`box$,
|
|
|
|
FrontEndResource["RGBColorValueSelector"], {
|
|
|
|
0, {Left, Bottom}}, {Left, Top},
|
|
|
|
"ClosingActions" -> {
|
|
|
|
"SelectionDeparture", "ParentChanged",
|
|
|
|
"EvaluatorQuit"}]]]], BaseStyle -> Inherited, Evaluator ->
|
|
|
|
Automatic, Method -> "Preemptive"],
|
|
|
|
RGBColor[1, 0.5, 0], Editable -> False, Selectable ->
|
|
|
|
False]}], "]"}], ",",
|
|
|
|
RowBox[{"Directive", "[",
|
|
|
|
RowBox[{
|
|
|
|
RowBox[{"PointSize", "[", "0.009166666666666668`", "]"}],
|
|
|
|
",",
|
|
|
|
RowBox[{"CapForm", "[", "\"Butt\"", "]"}], ",",
|
|
|
|
RowBox[{"AbsoluteThickness", "[", "1.6`", "]"}], ",",
|
|
|
|
RowBox[{"Thickness", "[", "0.01`", "]"}], ",",
|
|
|
|
InterpretationBox[
|
|
|
|
ButtonBox[
|
|
|
|
TooltipBox[
|
|
|
|
GraphicsBox[{{
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{0, 0}]}, {
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{1, -1}]}, {
|
|
|
|
RGBColor[1, 0, 0],
|
|
|
|
RectangleBox[{0, -1}, {2, 1}]}}, DefaultBaseStyle ->
|
|
|
|
"ColorSwatchGraphics", AspectRatio -> 1, Frame -> True,
|
|
|
|
FrameStyle -> RGBColor[0.6666666666666666, 0., 0.],
|
|
|
|
FrameTicks -> None, PlotRangePadding -> None, ImageSize ->
|
|
|
|
Dynamic[{
|
|
|
|
Automatic, 1.35 CurrentValue["FontCapHeight"]/
|
|
|
|
AbsoluteCurrentValue[Magnification]}]],
|
|
|
|
StyleBox[
|
|
|
|
RowBox[{"RGBColor", "[",
|
|
|
|
RowBox[{"1", ",", "0", ",", "0"}], "]"}], NumberMarks ->
|
|
|
|
False]], Appearance -> None, BaseStyle -> {},
|
|
|
|
BaselinePosition -> Baseline, DefaultBaseStyle -> {},
|
|
|
|
ButtonFunction :> With[{Typeset`box$ = EvaluationBox[]},
|
|
|
|
If[
|
|
|
|
Not[
|
|
|
|
AbsoluteCurrentValue["Deployed"]],
|
|
|
|
SelectionMove[Typeset`box$, All, Expression];
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialAlpha = 1;
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialColor =
|
|
|
|
RGBColor[1, 0, 0];
|
|
|
|
FrontEnd`Private`$ColorSelectorUseMakeBoxes = True;
|
|
|
|
MathLink`CallFrontEnd[
|
|
|
|
FrontEnd`AttachCell[Typeset`box$,
|
|
|
|
FrontEndResource["RGBColorValueSelector"], {
|
|
|
|
0, {Left, Bottom}}, {Left, Top},
|
|
|
|
"ClosingActions" -> {
|
|
|
|
"SelectionDeparture", "ParentChanged",
|
|
|
|
"EvaluatorQuit"}]]]], BaseStyle -> Inherited, Evaluator ->
|
|
|
|
Automatic, Method -> "Preemptive"],
|
|
|
|
RGBColor[1, 0, 0], Editable -> False, Selectable ->
|
|
|
|
False]}], "]"}], ",",
|
|
|
|
RowBox[{"Directive", "[",
|
|
|
|
RowBox[{
|
|
|
|
RowBox[{"PointSize", "[", "0.009166666666666668`", "]"}],
|
|
|
|
",",
|
|
|
|
RowBox[{"CapForm", "[", "\"Butt\"", "]"}], ",",
|
|
|
|
RowBox[{"AbsoluteThickness", "[", "1.6`", "]"}], ",",
|
|
|
|
RowBox[{"Thickness", "[", "0.01`", "]"}], ",",
|
|
|
|
InterpretationBox[
|
|
|
|
ButtonBox[
|
|
|
|
TooltipBox[
|
|
|
|
GraphicsBox[{{
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{0, 0}]}, {
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{1, -1}]}, {
|
|
|
|
RGBColor[0, 0, 1],
|
|
|
|
RectangleBox[{0, -1}, {2, 1}]}}, DefaultBaseStyle ->
|
|
|
|
"ColorSwatchGraphics", AspectRatio -> 1, Frame -> True,
|
|
|
|
FrameStyle -> RGBColor[0., 0., 0.6666666666666666],
|
|
|
|
FrameTicks -> None, PlotRangePadding -> None, ImageSize ->
|
|
|
|
Dynamic[{
|
|
|
|
Automatic, 1.35 CurrentValue["FontCapHeight"]/
|
|
|
|
AbsoluteCurrentValue[Magnification]}]],
|
|
|
|
StyleBox[
|
|
|
|
RowBox[{"RGBColor", "[",
|
|
|
|
RowBox[{"0", ",", "0", ",", "1"}], "]"}], NumberMarks ->
|
|
|
|
False]], Appearance -> None, BaseStyle -> {},
|
|
|
|
BaselinePosition -> Baseline, DefaultBaseStyle -> {},
|
|
|
|
ButtonFunction :> With[{Typeset`box$ = EvaluationBox[]},
|
|
|
|
If[
|
|
|
|
Not[
|
|
|
|
AbsoluteCurrentValue["Deployed"]],
|
|
|
|
SelectionMove[Typeset`box$, All, Expression];
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialAlpha = 1;
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialColor =
|
|
|
|
RGBColor[0, 0, 1];
|
|
|
|
FrontEnd`Private`$ColorSelectorUseMakeBoxes = True;
|
|
|
|
MathLink`CallFrontEnd[
|
|
|
|
FrontEnd`AttachCell[Typeset`box$,
|
|
|
|
FrontEndResource["RGBColorValueSelector"], {
|
|
|
|
0, {Left, Bottom}}, {Left, Top},
|
|
|
|
"ClosingActions" -> {
|
|
|
|
"SelectionDeparture", "ParentChanged",
|
|
|
|
"EvaluatorQuit"}]]]], BaseStyle -> Inherited, Evaluator ->
|
|
|
|
Automatic, Method -> "Preemptive"],
|
|
|
|
RGBColor[0, 0, 1], Editable -> False, Selectable ->
|
|
|
|
False]}], "]"}], ",",
|
|
|
|
RowBox[{"Directive", "[",
|
|
|
|
RowBox[{
|
|
|
|
RowBox[{"PointSize", "[", "0.009166666666666668`", "]"}],
|
|
|
|
",",
|
|
|
|
RowBox[{"CapForm", "[", "\"Butt\"", "]"}], ",",
|
|
|
|
RowBox[{"AbsoluteThickness", "[", "1.6`", "]"}], ",",
|
|
|
|
RowBox[{"Thickness", "[", "0.01`", "]"}], ",",
|
|
|
|
InterpretationBox[
|
|
|
|
ButtonBox[
|
|
|
|
TooltipBox[
|
|
|
|
GraphicsBox[{{
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{0, 0}]}, {
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{1, -1}]}, {
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{0, -1}, {2, 1}]}}, DefaultBaseStyle ->
|
|
|
|
"ColorSwatchGraphics", AspectRatio -> 1, Frame -> True,
|
|
|
|
FrameStyle -> GrayLevel[0.], FrameTicks -> None,
|
|
|
|
PlotRangePadding -> None, ImageSize ->
|
|
|
|
Dynamic[{
|
|
|
|
Automatic, 1.35 CurrentValue["FontCapHeight"]/
|
|
|
|
AbsoluteCurrentValue[Magnification]}]],
|
|
|
|
StyleBox[
|
|
|
|
RowBox[{"GrayLevel", "[", "0", "]"}], NumberMarks ->
|
|
|
|
False]], Appearance -> None, BaseStyle -> {},
|
|
|
|
BaselinePosition -> Baseline, DefaultBaseStyle -> {},
|
|
|
|
ButtonFunction :> With[{Typeset`box$ = EvaluationBox[]},
|
|
|
|
If[
|
|
|
|
Not[
|
|
|
|
AbsoluteCurrentValue["Deployed"]],
|
|
|
|
SelectionMove[Typeset`box$, All, Expression];
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialAlpha = 1;
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialColor =
|
|
|
|
GrayLevel[0];
|
|
|
|
FrontEnd`Private`$ColorSelectorUseMakeBoxes = True;
|
|
|
|
MathLink`CallFrontEnd[
|
|
|
|
FrontEnd`AttachCell[Typeset`box$,
|
|
|
|
FrontEndResource["GrayLevelColorValueSelector"], {
|
|
|
|
0, {Left, Bottom}}, {Left, Top},
|
|
|
|
"ClosingActions" -> {
|
|
|
|
"SelectionDeparture", "ParentChanged",
|
|
|
|
"EvaluatorQuit"}]]]], BaseStyle -> Inherited, Evaluator ->
|
|
|
|
Automatic, Method -> "Preemptive"],
|
|
|
|
GrayLevel[0], Editable -> False, Selectable -> False]}],
|
|
|
|
"]"}], ",",
|
|
|
|
RowBox[{"Directive", "[",
|
|
|
|
RowBox[{
|
|
|
|
RowBox[{"PointSize", "[", "0.009166666666666668`", "]"}],
|
|
|
|
",",
|
|
|
|
RowBox[{"CapForm", "[", "\"Butt\"", "]"}], ",",
|
|
|
|
RowBox[{"AbsoluteThickness", "[", "1.6`", "]"}], ",",
|
|
|
|
RowBox[{"Thickness", "[", "0.01`", "]"}], ",",
|
|
|
|
InterpretationBox[
|
|
|
|
ButtonBox[
|
|
|
|
TooltipBox[
|
|
|
|
GraphicsBox[{{
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{0, 0}]}, {
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{1, -1}]}, {
|
|
|
|
GrayLevel[0.5],
|
|
|
|
RectangleBox[{0, -1}, {2, 1}]}}, DefaultBaseStyle ->
|
|
|
|
"ColorSwatchGraphics", AspectRatio -> 1, Frame -> True,
|
|
|
|
FrameStyle -> GrayLevel[0.33333333333333337`], FrameTicks ->
|
|
|
|
None, PlotRangePadding -> None, ImageSize ->
|
|
|
|
Dynamic[{
|
|
|
|
Automatic, 1.35 CurrentValue["FontCapHeight"]/
|
|
|
|
AbsoluteCurrentValue[Magnification]}]],
|
|
|
|
StyleBox[
|
|
|
|
RowBox[{"GrayLevel", "[", "0.5`", "]"}], NumberMarks ->
|
|
|
|
False]], Appearance -> None, BaseStyle -> {},
|
|
|
|
BaselinePosition -> Baseline, DefaultBaseStyle -> {},
|
|
|
|
ButtonFunction :> With[{Typeset`box$ = EvaluationBox[]},
|
|
|
|
If[
|
|
|
|
Not[
|
|
|
|
AbsoluteCurrentValue["Deployed"]],
|
|
|
|
SelectionMove[Typeset`box$, All, Expression];
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialAlpha = 1;
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialColor =
|
|
|
|
GrayLevel[0.5];
|
|
|
|
FrontEnd`Private`$ColorSelectorUseMakeBoxes = True;
|
|
|
|
MathLink`CallFrontEnd[
|
|
|
|
FrontEnd`AttachCell[Typeset`box$,
|
|
|
|
FrontEndResource["GrayLevelColorValueSelector"], {
|
|
|
|
0, {Left, Bottom}}, {Left, Top},
|
|
|
|
"ClosingActions" -> {
|
|
|
|
"SelectionDeparture", "ParentChanged",
|
|
|
|
"EvaluatorQuit"}]]]], BaseStyle -> Inherited, Evaluator ->
|
|
|
|
Automatic, Method -> "Preemptive"],
|
|
|
|
GrayLevel[0.5], Editable -> False, Selectable -> False]}],
|
|
|
|
"]"}]}], "}"}], ",",
|
|
|
|
RowBox[{"{",
|
|
|
|
RowBox[{#, ",", #2, ",", #3, ",", #4, ",", #5}], "}"}], ",",
|
|
|
|
RowBox[{"LegendMarkers", "\[Rule]",
|
|
|
|
RowBox[{"{",
|
|
|
|
RowBox[{
|
|
|
|
RowBox[{"{",
|
|
|
|
RowBox[{"False", ",", "Automatic"}], "}"}], ",",
|
|
|
|
RowBox[{"{",
|
|
|
|
RowBox[{"False", ",", "Automatic"}], "}"}], ",",
|
|
|
|
RowBox[{"{",
|
|
|
|
RowBox[{"False", ",", "Automatic"}], "}"}], ",",
|
|
|
|
RowBox[{"{",
|
|
|
|
RowBox[{"False", ",", "Automatic"}], "}"}], ",",
|
|
|
|
RowBox[{"{",
|
|
|
|
RowBox[{"False", ",", "Automatic"}], "}"}]}], "}"}]}], ",",
|
|
|
|
RowBox[{"Joined", "\[Rule]",
|
|
|
|
RowBox[{"{",
|
|
|
|
|
|
|
|
RowBox[{
|
|
|
|
"True", ",", "True", ",", "True", ",", "True", ",", "True"}],
|
|
|
|
"}"}]}], ",",
|
|
|
|
RowBox[{"LabelStyle", "\[Rule]",
|
|
|
|
RowBox[{"{",
|
|
|
|
RowBox[{"FontFamily", "\[Rule]", "\"Times\""}], "}"}]}], ",",
|
|
|
|
RowBox[{"LegendLayout", "\[Rule]", "\"Column\""}]}], "]"}]& )],
|
|
|
|
Scaled[{0.99, 0.99}], ImageScaled[{1, 1}],
|
|
|
|
BaseStyle->{FontSize -> Larger},
|
|
|
|
FormatType->StandardForm]},
|
|
|
|
AspectRatio->1,
|
|
|
|
Axes->{False, False},
|
|
|
|
AxesLabel->{None, None},
|
|
|
|
AxesOrigin->{1.1, -199.},
|
|
|
|
BaseStyle->18,
|
|
|
|
DisplayFunction->Identity,
|
|
|
|
Frame->{{True, True}, {True, True}},
|
|
|
|
FrameLabel->{{
|
|
|
|
FormBox[
|
|
|
|
StyleBox[
|
|
|
|
"\"\\!\\(\\*StyleBox[\\\"E\\\",FontSlant->\\\"Italic\\\"]\\)(F-F) \
|
|
|
|
(hartree)\"", FontSize -> 20, StripOnInput -> False], TraditionalForm],
|
|
|
|
None}, {
|
|
|
|
FormBox[
|
|
|
|
StyleBox[
|
|
|
|
"\"\\!\\(\\*SubscriptBox[\\(R\\), \\(F - F\\)]\\) (\[Angstrom])\"",
|
|
|
|
FontSize -> 20, StripOnInput -> False], TraditionalForm], None}},
|
|
|
|
FrameStyle->Automatic,
|
|
|
|
FrameTicks->{{Automatic, Automatic}, {Automatic, Automatic}},
|
|
|
|
GridLines->{Automatic, Automatic},
|
|
|
|
GridLinesStyle->Directive[
|
|
|
|
GrayLevel[0.5, 0.4]],
|
|
|
|
ImageSize->500,
|
|
|
|
LabelStyle->{FontFamily -> "Times"},
|
|
|
|
Method->{
|
|
|
|
"OptimizePlotMarkers" -> True, "OptimizePlotMarkers" -> True,
|
|
|
|
"CoordinatesToolOptions" -> {"DisplayFunction" -> ({
|
|
|
|
Identity[
|
|
|
|
Part[#, 1]],
|
|
|
|
Identity[
|
|
|
|
Part[#, 2]]}& ), "CopiedValueFunction" -> ({
|
|
|
|
Identity[
|
|
|
|
Part[#, 1]],
|
|
|
|
Identity[
|
|
|
|
Part[#, 2]]}& )}},
|
2022-04-25 14:17:16 +02:00
|
|
|
PlotRange->{{1.1, 1.65}, {-199.125, -199}},
|
2022-04-21 16:23:20 +02:00
|
|
|
PlotRangeClipping->True,
|
|
|
|
PlotRangePadding->{{0, 0}, {0, 0}},
|
|
|
|
Ticks->{Automatic, Automatic}],
|
|
|
|
InterpretTemplate[Legended[
|
|
|
|
Graphics[{{}, {{{}, {}, {
|
|
|
|
Hue[0.67, 0.6, 0.6],
|
|
|
|
Directive[
|
|
|
|
PointSize[0.009166666666666668],
|
|
|
|
CapForm["Butt"],
|
|
|
|
AbsoluteThickness[1.6],
|
|
|
|
Thickness[0.01],
|
|
|
|
RGBColor[1, 0.5, 0]],
|
2022-04-25 14:17:16 +02:00
|
|
|
Line[{{1.1186000920834196`, -199.}, {1.16419, -199.0388640823}, {
|
|
|
|
1.21711, -199.0692686079}, {1.27002, -199.0889640392}, {
|
|
|
|
1.32294, -199.1009044038}, {1.37586, -199.1072986871}, {
|
|
|
|
1.42878, -199.1097975546}, {1.4817, -199.1096214147}, {
|
|
|
|
1.53461, -199.1076633248}, {1.58753, -199.1045747396}, {
|
|
|
|
1.64045, -199.1008324508}, {1.69337, -199.0967858098}, {
|
|
|
|
1.74628, -199.0926887251}}]}, {
|
2022-04-21 16:23:20 +02:00
|
|
|
Hue[0.9060679774997897, 0.6, 0.6],
|
|
|
|
Directive[
|
|
|
|
PointSize[0.009166666666666668],
|
|
|
|
CapForm["Butt"],
|
|
|
|
AbsoluteThickness[1.6],
|
|
|
|
Thickness[0.01],
|
|
|
|
RGBColor[1, 0, 0]],
|
2022-04-25 14:17:16 +02:00
|
|
|
Line[{{1.1246157483711674`, -199.}, {1.16419, -199.0333451097}, {
|
|
|
|
1.21711, -199.0631340935}, {1.27002, -199.082113329}, {
|
|
|
|
1.32294, -199.0932285028}, {1.37586, -199.0986805911}, {
|
|
|
|
1.42878, -199.1001132928}, {1.4817, -199.0987420273}, {
|
|
|
|
1.53461, -199.095457527}, {1.58753, -199.090912857}, {
|
|
|
|
1.64045, -199.0855910885}, {1.69337, -199.0798534114}, {
|
|
|
|
1.74628, -199.073970804}}]}, {
|
2022-04-21 16:23:20 +02:00
|
|
|
Hue[0.1421359549995791, 0.6, 0.6],
|
|
|
|
Directive[
|
|
|
|
PointSize[0.009166666666666668],
|
|
|
|
CapForm["Butt"],
|
|
|
|
AbsoluteThickness[1.6],
|
|
|
|
Thickness[0.01],
|
|
|
|
RGBColor[0, 0, 1]],
|
|
|
|
Line[CompressedData["
|
2022-04-25 14:17:16 +02:00
|
|
|
1:eJxTTMoPSmViYGAQB2IQHaLB1XH/zEd7BhB4kHEATDN8si8wVJ6ZCuSngcEn
|
|
|
|
e0+BtDbBhxkHzp4BgU/219JPX1kD5BuDwWf7sse8p9UfZRyYNRMEPttzTih8
|
|
|
|
2PkIZt4X+4uVOf43H8HM+2Iv+MOmUPgxzLwv9oFuG1V8H8PM+2qfGBLsU/oY
|
|
|
|
Zt5X+01JiaJdj2HmfbPncVdOnfwYZt43ex0WkfOL4OZ9s783KU9mA9y87/bb
|
|
|
|
JiTzbYKb991ePYWVdx3cvB/27NVREsvg5v2wX6agGjkZbt4P+/lT9n9rhJv3
|
|
|
|
03428+OUbLh5P+1PFTvsCYWb98v+rvpzVzu4eb/sV16/ul0eyAcAl5ux3w==
|
|
|
|
|
2022-04-21 16:23:20 +02:00
|
|
|
"]]}, {
|
|
|
|
Hue[0.37820393249936934`, 0.6, 0.6],
|
|
|
|
Directive[
|
|
|
|
PointSize[0.009166666666666668],
|
|
|
|
CapForm["Butt"],
|
|
|
|
AbsoluteThickness[1.6],
|
|
|
|
Thickness[0.01],
|
|
|
|
GrayLevel[0]],
|
|
|
|
Line[CompressedData["
|
2022-04-25 14:17:16 +02:00
|
|
|
1:eJxTTMoPSmViYGCQBGIQHdaymnPLvY/2DCDwIOMAmGb4ZM/zsv6BE5CfBgaf
|
|
|
|
7FlTup3fAflnz4DAJ3u19yvZah5mHDAGg8/2Dh1umh+A/FkzQeCzvaBdvZjf
|
|
|
|
I5h5X+yrmVLOzngEM++L/eO9DXcuPYKZ98X+p5BO079HMPO+2svZBGyRfQwz
|
|
|
|
76u9WO4jTaPHMPO+2XupVSTZPoaZ983ewHv5GofHMPO+2T9YPEsbJA8x77s9
|
|
|
|
/2HNO8Zw877bO2pMn6kKN++H/cdlrxWF4eb9sPfi/Sf5F+6+H/bevcKCT+Du
|
|
|
|
+2kvcVO05cQjmHk/7Z//in2wCu7fX/YzNJjbuuH+/WV/0XT3ySy4eb/sbx6o
|
|
|
|
/+YBN++3fafYBn81IB8AMdvFfg==
|
2022-04-21 16:23:20 +02:00
|
|
|
"]]}, {
|
|
|
|
Hue[0.6142719099991583, 0.6, 0.6],
|
|
|
|
Directive[
|
|
|
|
PointSize[0.009166666666666668],
|
|
|
|
CapForm["Butt"],
|
|
|
|
AbsoluteThickness[1.6],
|
|
|
|
Thickness[0.01],
|
|
|
|
GrayLevel[0.5]],
|
|
|
|
Line[CompressedData["
|
2022-04-25 14:17:16 +02:00
|
|
|
1:eJxTTMoPSmViYGCQBGIQ3f6U07Prxkd7BhB4kHEATDN8stc6s87FH8hPA4NP
|
|
|
|
9mpxnqt+Aflnz4DAJ/sdrwqyOx5mHDAGg8/2yv2qnX+A/FkzQeCzvX7l9fyo
|
|
|
|
RzDzvtj7ZJ+TX/oIZt4X+8C4vRr3H8HM+2Lv58BxiusxzLyv9nUbm39pPoaZ
|
|
|
|
99W+dsrTQrvHMPO+2S/zi9zg+Rhm3jf7Lr4nLL6PYeZ9s7fSZJrsCTfvu/2b
|
|
|
|
7SfCHeDmfbfft36lnhHcvB/2Rk8vXJWHm/fDPjZd/RMn3Lwf9qsPvhP6+Ahm
|
|
|
|
3k97GfOvW64+gpn3097LJcl1B9y/v+xvt7KpzIT795d9irTh0gq4f3/Z28lq
|
|
|
|
C4fDzfttz6rEuMEEyAcAViHDzA==
|
2022-04-21 16:23:20 +02:00
|
|
|
"]]}}}, {{}, {}}}, {
|
|
|
|
DisplayFunction -> Identity, DisplayFunction -> Identity, AspectRatio ->
|
|
|
|
1, Axes -> {False, False}, AxesLabel -> {None, None},
|
|
|
|
AxesOrigin -> {1.1, -199.}, BaseStyle -> 18, DisplayFunction :>
|
|
|
|
Identity, Frame -> {{True, True}, {True, True}}, FrameLabel -> {{
|
|
|
|
Style[
|
|
|
|
"\!\(\*StyleBox[\"E\",FontSlant->\"Italic\"]\)(F-F) (hartree)",
|
|
|
|
FontSize -> 20], None}, {
|
|
|
|
Style[
|
|
|
|
"\!\(\*SubscriptBox[\(R\), \(F - F\)]\) (\[Angstrom])", FontSize ->
|
|
|
|
20], None}}, FrameStyle -> Automatic,
|
|
|
|
FrameTicks -> {{Automatic, Automatic}, {Automatic, Automatic}},
|
|
|
|
GridLines -> {Automatic, Automatic}, GridLinesStyle -> Directive[
|
|
|
|
GrayLevel[0.5, 0.4]], ImageSize -> 500,
|
|
|
|
LabelStyle -> {FontFamily -> "Times"},
|
|
|
|
Method -> {
|
|
|
|
"OptimizePlotMarkers" -> True, "OptimizePlotMarkers" -> True,
|
|
|
|
"CoordinatesToolOptions" -> {"DisplayFunction" -> ({
|
|
|
|
Identity[
|
|
|
|
Part[#, 1]],
|
|
|
|
Identity[
|
|
|
|
Part[#, 2]]}& ), "CopiedValueFunction" -> ({
|
|
|
|
Identity[
|
|
|
|
Part[#, 1]],
|
|
|
|
Identity[
|
2022-04-25 14:17:16 +02:00
|
|
|
Part[#, 2]]}& )}}, PlotRange -> {{1.1, 1.65}, {-199.125, -199}},
|
2022-04-21 16:23:20 +02:00
|
|
|
PlotRangeClipping -> True, PlotRangePadding -> {{0, 0}, {0, 0}},
|
|
|
|
Ticks -> {Automatic, Automatic}}],
|
|
|
|
Placed[
|
|
|
|
Unevaluated[
|
|
|
|
PointLegend[{
|
|
|
|
Directive[
|
|
|
|
PointSize[0.009166666666666668],
|
|
|
|
CapForm["Butt"],
|
|
|
|
AbsoluteThickness[1.6],
|
|
|
|
Thickness[0.01],
|
|
|
|
RGBColor[1, 0.5, 0]],
|
|
|
|
Directive[
|
|
|
|
PointSize[0.009166666666666668],
|
|
|
|
CapForm["Butt"],
|
|
|
|
AbsoluteThickness[1.6],
|
|
|
|
Thickness[0.01],
|
|
|
|
RGBColor[1, 0, 0]],
|
|
|
|
Directive[
|
|
|
|
PointSize[0.009166666666666668],
|
|
|
|
CapForm["Butt"],
|
|
|
|
AbsoluteThickness[1.6],
|
|
|
|
Thickness[0.01],
|
|
|
|
RGBColor[0, 0, 1]],
|
|
|
|
Directive[
|
|
|
|
PointSize[0.009166666666666668],
|
|
|
|
CapForm["Butt"],
|
|
|
|
AbsoluteThickness[1.6],
|
|
|
|
Thickness[0.01],
|
|
|
|
GrayLevel[0]],
|
|
|
|
Directive[
|
|
|
|
PointSize[0.009166666666666668],
|
|
|
|
CapForm["Butt"],
|
|
|
|
AbsoluteThickness[1.6],
|
|
|
|
Thickness[0.01],
|
|
|
|
GrayLevel[0.5]]}, {
|
|
|
|
Style["CC3", FontSize -> 20],
|
|
|
|
Style["CCSD", FontSize -> 20],
|
|
|
|
Style[
|
|
|
|
"BSE@\!\(\*SubscriptBox[\(G\), \(0\)]\)\!\(\*SubscriptBox[\(W\), \
|
2022-04-25 14:17:16 +02:00
|
|
|
\(0\)]\)@HF (\[Eta] = 0 au)", FontSize -> 20],
|
2022-04-21 16:23:20 +02:00
|
|
|
Style[
|
|
|
|
"BSE@\!\(\*SubscriptBox[\(G\), \(0\)]\)\!\(\*SubscriptBox[\(W\), \
|
2022-04-25 14:17:16 +02:00
|
|
|
\(0\)]\)@HF (\[Eta] = 1 au)", FontSize -> 20],
|
|
|
|
Style["BSE@evGW@HF (\[Eta] = 1 au)", FontSize -> 20]},
|
2022-04-21 16:23:20 +02:00
|
|
|
LegendMarkers -> {{False, Automatic}, {False, Automatic}, {
|
|
|
|
False, Automatic}, {False, Automatic}, {False, Automatic}},
|
|
|
|
Joined -> {True, True, True, True, True},
|
|
|
|
LabelStyle -> {FontFamily -> "Times"}, LegendLayout -> "Column"]], {
|
|
|
|
Right, Top}, Identity]]& ],
|
|
|
|
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|
|
GrayLevel[0]]],
|
|
|
|
PointSize[0.5],
|
|
|
|
CapForm["Butt"],
|
|
|
|
AbsoluteThickness[1.6],
|
|
|
|
Thickness[0.18],
|
|
|
|
GrayLevel[0.5]], {}}}, AspectRatio -> Full,
|
|
|
|
ImageSize -> {20, 10}, PlotRangePadding -> None,
|
|
|
|
ImagePadding -> Automatic,
|
|
|
|
BaselinePosition -> (Scaled[0.1] -> Baseline)], #5}},
|
|
|
|
GridBoxAlignment -> {
|
|
|
|
"Columns" -> {Center, Left}, "Rows" -> {{Baseline}}},
|
|
|
|
AutoDelete -> False,
|
|
|
|
GridBoxDividers -> {
|
|
|
|
"Columns" -> {{False}}, "Rows" -> {{False}}},
|
|
|
|
GridBoxItemSize -> {"Columns" -> {{All}}, "Rows" -> {{All}}},
|
|
|
|
GridBoxSpacings -> {
|
|
|
|
"Columns" -> {{0.5}}, "Rows" -> {{0.8}}}], "Grid"]}},
|
|
|
|
GridBoxAlignment -> {"Columns" -> {{Left}}, "Rows" -> {{Top}}},
|
|
|
|
AutoDelete -> False,
|
|
|
|
GridBoxItemSize -> {
|
|
|
|
"Columns" -> {{Automatic}}, "Rows" -> {{Automatic}}},
|
|
|
|
GridBoxSpacings -> {"Columns" -> {{1}}, "Rows" -> {{0}}}],
|
|
|
|
"Grid"], Alignment -> Left, AppearanceElements -> None,
|
|
|
|
ImageMargins -> {{5, 5}, {5, 5}}, ImageSizeAction ->
|
|
|
|
"ResizeToFit"], LineIndent -> 0, StripOnInput -> False], {
|
|
|
|
FontFamily -> "Times"}, Background -> Automatic, StripOnInput ->
|
|
|
|
False], TraditionalForm]& ),
|
|
|
|
Editable->True,
|
|
|
|
InterpretationFunction:>(RowBox[{"PointLegend", "[",
|
|
|
|
RowBox[{
|
|
|
|
RowBox[{"{",
|
|
|
|
RowBox[{
|
|
|
|
RowBox[{"Directive", "[",
|
|
|
|
RowBox[{
|
|
|
|
RowBox[{"PointSize", "[", "0.009166666666666668`", "]"}],
|
|
|
|
",",
|
|
|
|
RowBox[{"CapForm", "[", "\"Butt\"", "]"}], ",",
|
|
|
|
RowBox[{"AbsoluteThickness", "[", "1.6`", "]"}], ",",
|
|
|
|
RowBox[{"Thickness", "[", "0.01`", "]"}], ",",
|
|
|
|
InterpretationBox[
|
|
|
|
ButtonBox[
|
|
|
|
TooltipBox[
|
|
|
|
GraphicsBox[{{
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{0, 0}]}, {
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{1, -1}]}, {
|
|
|
|
RGBColor[1, 0.5, 0],
|
|
|
|
RectangleBox[{0, -1}, {2, 1}]}}, DefaultBaseStyle ->
|
|
|
|
"ColorSwatchGraphics", AspectRatio -> 1, Frame -> True,
|
|
|
|
FrameStyle ->
|
|
|
|
RGBColor[0.6666666666666666, 0.33333333333333337`, 0.],
|
|
|
|
FrameTicks -> None, PlotRangePadding -> None, ImageSize ->
|
|
|
|
Dynamic[{
|
|
|
|
Automatic, 1.35 CurrentValue["FontCapHeight"]/
|
|
|
|
AbsoluteCurrentValue[Magnification]}]],
|
|
|
|
StyleBox[
|
|
|
|
RowBox[{"RGBColor", "[",
|
|
|
|
RowBox[{"1", ",", "0.5`", ",", "0"}], "]"}], NumberMarks ->
|
|
|
|
False]], Appearance -> None, BaseStyle -> {},
|
|
|
|
BaselinePosition -> Baseline, DefaultBaseStyle -> {},
|
|
|
|
ButtonFunction :> With[{Typeset`box$ = EvaluationBox[]},
|
|
|
|
If[
|
|
|
|
Not[
|
|
|
|
AbsoluteCurrentValue["Deployed"]],
|
|
|
|
SelectionMove[Typeset`box$, All, Expression];
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialAlpha = 1;
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialColor =
|
|
|
|
RGBColor[1, 0.5, 0];
|
|
|
|
FrontEnd`Private`$ColorSelectorUseMakeBoxes = True;
|
|
|
|
MathLink`CallFrontEnd[
|
|
|
|
FrontEnd`AttachCell[Typeset`box$,
|
|
|
|
FrontEndResource["RGBColorValueSelector"], {
|
|
|
|
0, {Left, Bottom}}, {Left, Top},
|
|
|
|
"ClosingActions" -> {
|
|
|
|
"SelectionDeparture", "ParentChanged",
|
|
|
|
"EvaluatorQuit"}]]]], BaseStyle -> Inherited, Evaluator ->
|
|
|
|
Automatic, Method -> "Preemptive"],
|
|
|
|
RGBColor[1, 0.5, 0], Editable -> False, Selectable ->
|
|
|
|
False]}], "]"}], ",",
|
|
|
|
RowBox[{"Directive", "[",
|
|
|
|
RowBox[{
|
|
|
|
RowBox[{"PointSize", "[", "0.009166666666666668`", "]"}],
|
|
|
|
",",
|
|
|
|
RowBox[{"CapForm", "[", "\"Butt\"", "]"}], ",",
|
|
|
|
RowBox[{"AbsoluteThickness", "[", "1.6`", "]"}], ",",
|
|
|
|
RowBox[{"Thickness", "[", "0.01`", "]"}], ",",
|
|
|
|
InterpretationBox[
|
|
|
|
ButtonBox[
|
|
|
|
TooltipBox[
|
|
|
|
GraphicsBox[{{
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{0, 0}]}, {
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{1, -1}]}, {
|
|
|
|
RGBColor[1, 0, 0],
|
|
|
|
RectangleBox[{0, -1}, {2, 1}]}}, DefaultBaseStyle ->
|
|
|
|
"ColorSwatchGraphics", AspectRatio -> 1, Frame -> True,
|
|
|
|
FrameStyle -> RGBColor[0.6666666666666666, 0., 0.],
|
|
|
|
FrameTicks -> None, PlotRangePadding -> None, ImageSize ->
|
|
|
|
Dynamic[{
|
|
|
|
Automatic, 1.35 CurrentValue["FontCapHeight"]/
|
|
|
|
AbsoluteCurrentValue[Magnification]}]],
|
|
|
|
StyleBox[
|
|
|
|
RowBox[{"RGBColor", "[",
|
|
|
|
RowBox[{"1", ",", "0", ",", "0"}], "]"}], NumberMarks ->
|
|
|
|
False]], Appearance -> None, BaseStyle -> {},
|
|
|
|
BaselinePosition -> Baseline, DefaultBaseStyle -> {},
|
|
|
|
ButtonFunction :> With[{Typeset`box$ = EvaluationBox[]},
|
|
|
|
If[
|
|
|
|
Not[
|
|
|
|
AbsoluteCurrentValue["Deployed"]],
|
|
|
|
SelectionMove[Typeset`box$, All, Expression];
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialAlpha = 1;
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialColor =
|
|
|
|
RGBColor[1, 0, 0];
|
|
|
|
FrontEnd`Private`$ColorSelectorUseMakeBoxes = True;
|
|
|
|
MathLink`CallFrontEnd[
|
|
|
|
FrontEnd`AttachCell[Typeset`box$,
|
|
|
|
FrontEndResource["RGBColorValueSelector"], {
|
|
|
|
0, {Left, Bottom}}, {Left, Top},
|
|
|
|
"ClosingActions" -> {
|
|
|
|
"SelectionDeparture", "ParentChanged",
|
|
|
|
"EvaluatorQuit"}]]]], BaseStyle -> Inherited, Evaluator ->
|
|
|
|
Automatic, Method -> "Preemptive"],
|
|
|
|
RGBColor[1, 0, 0], Editable -> False, Selectable ->
|
|
|
|
False]}], "]"}], ",",
|
|
|
|
RowBox[{"Directive", "[",
|
|
|
|
RowBox[{
|
|
|
|
RowBox[{"PointSize", "[", "0.009166666666666668`", "]"}],
|
|
|
|
",",
|
|
|
|
RowBox[{"CapForm", "[", "\"Butt\"", "]"}], ",",
|
|
|
|
RowBox[{"AbsoluteThickness", "[", "1.6`", "]"}], ",",
|
|
|
|
RowBox[{"Thickness", "[", "0.01`", "]"}], ",",
|
|
|
|
InterpretationBox[
|
|
|
|
ButtonBox[
|
|
|
|
TooltipBox[
|
|
|
|
GraphicsBox[{{
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{0, 0}]}, {
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{1, -1}]}, {
|
|
|
|
RGBColor[0, 0, 1],
|
|
|
|
RectangleBox[{0, -1}, {2, 1}]}}, DefaultBaseStyle ->
|
|
|
|
"ColorSwatchGraphics", AspectRatio -> 1, Frame -> True,
|
|
|
|
FrameStyle -> RGBColor[0., 0., 0.6666666666666666],
|
|
|
|
FrameTicks -> None, PlotRangePadding -> None, ImageSize ->
|
|
|
|
Dynamic[{
|
|
|
|
Automatic, 1.35 CurrentValue["FontCapHeight"]/
|
|
|
|
AbsoluteCurrentValue[Magnification]}]],
|
|
|
|
StyleBox[
|
|
|
|
RowBox[{"RGBColor", "[",
|
|
|
|
RowBox[{"0", ",", "0", ",", "1"}], "]"}], NumberMarks ->
|
|
|
|
False]], Appearance -> None, BaseStyle -> {},
|
|
|
|
BaselinePosition -> Baseline, DefaultBaseStyle -> {},
|
|
|
|
ButtonFunction :> With[{Typeset`box$ = EvaluationBox[]},
|
|
|
|
If[
|
|
|
|
Not[
|
|
|
|
AbsoluteCurrentValue["Deployed"]],
|
|
|
|
SelectionMove[Typeset`box$, All, Expression];
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialAlpha = 1;
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialColor =
|
|
|
|
RGBColor[0, 0, 1];
|
|
|
|
FrontEnd`Private`$ColorSelectorUseMakeBoxes = True;
|
|
|
|
MathLink`CallFrontEnd[
|
|
|
|
FrontEnd`AttachCell[Typeset`box$,
|
|
|
|
FrontEndResource["RGBColorValueSelector"], {
|
|
|
|
0, {Left, Bottom}}, {Left, Top},
|
|
|
|
"ClosingActions" -> {
|
|
|
|
"SelectionDeparture", "ParentChanged",
|
|
|
|
"EvaluatorQuit"}]]]], BaseStyle -> Inherited, Evaluator ->
|
|
|
|
Automatic, Method -> "Preemptive"],
|
|
|
|
RGBColor[0, 0, 1], Editable -> False, Selectable ->
|
|
|
|
False]}], "]"}], ",",
|
|
|
|
RowBox[{"Directive", "[",
|
|
|
|
RowBox[{
|
|
|
|
RowBox[{"PointSize", "[", "0.009166666666666668`", "]"}],
|
|
|
|
",",
|
|
|
|
RowBox[{"CapForm", "[", "\"Butt\"", "]"}], ",",
|
|
|
|
RowBox[{"AbsoluteThickness", "[", "1.6`", "]"}], ",",
|
|
|
|
RowBox[{"Thickness", "[", "0.01`", "]"}], ",",
|
|
|
|
InterpretationBox[
|
|
|
|
ButtonBox[
|
|
|
|
TooltipBox[
|
|
|
|
GraphicsBox[{{
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{0, 0}]}, {
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{1, -1}]}, {
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{0, -1}, {2, 1}]}}, DefaultBaseStyle ->
|
|
|
|
"ColorSwatchGraphics", AspectRatio -> 1, Frame -> True,
|
|
|
|
FrameStyle -> GrayLevel[0.], FrameTicks -> None,
|
|
|
|
PlotRangePadding -> None, ImageSize ->
|
|
|
|
Dynamic[{
|
|
|
|
Automatic, 1.35 CurrentValue["FontCapHeight"]/
|
|
|
|
AbsoluteCurrentValue[Magnification]}]],
|
|
|
|
StyleBox[
|
|
|
|
RowBox[{"GrayLevel", "[", "0", "]"}], NumberMarks ->
|
|
|
|
False]], Appearance -> None, BaseStyle -> {},
|
|
|
|
BaselinePosition -> Baseline, DefaultBaseStyle -> {},
|
|
|
|
ButtonFunction :> With[{Typeset`box$ = EvaluationBox[]},
|
|
|
|
If[
|
|
|
|
Not[
|
|
|
|
AbsoluteCurrentValue["Deployed"]],
|
|
|
|
SelectionMove[Typeset`box$, All, Expression];
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialAlpha = 1;
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialColor =
|
|
|
|
GrayLevel[0];
|
|
|
|
FrontEnd`Private`$ColorSelectorUseMakeBoxes = True;
|
|
|
|
MathLink`CallFrontEnd[
|
|
|
|
FrontEnd`AttachCell[Typeset`box$,
|
|
|
|
FrontEndResource["GrayLevelColorValueSelector"], {
|
|
|
|
0, {Left, Bottom}}, {Left, Top},
|
|
|
|
"ClosingActions" -> {
|
|
|
|
"SelectionDeparture", "ParentChanged",
|
|
|
|
"EvaluatorQuit"}]]]], BaseStyle -> Inherited, Evaluator ->
|
|
|
|
Automatic, Method -> "Preemptive"],
|
|
|
|
GrayLevel[0], Editable -> False, Selectable -> False]}],
|
|
|
|
"]"}], ",",
|
|
|
|
RowBox[{"Directive", "[",
|
|
|
|
RowBox[{
|
|
|
|
RowBox[{"PointSize", "[", "0.009166666666666668`", "]"}],
|
|
|
|
",",
|
|
|
|
RowBox[{"CapForm", "[", "\"Butt\"", "]"}], ",",
|
|
|
|
RowBox[{"AbsoluteThickness", "[", "1.6`", "]"}], ",",
|
|
|
|
RowBox[{"Thickness", "[", "0.01`", "]"}], ",",
|
|
|
|
InterpretationBox[
|
|
|
|
ButtonBox[
|
|
|
|
TooltipBox[
|
|
|
|
GraphicsBox[{{
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{0, 0}]}, {
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{1, -1}]}, {
|
|
|
|
GrayLevel[0.5],
|
|
|
|
RectangleBox[{0, -1}, {2, 1}]}}, DefaultBaseStyle ->
|
|
|
|
"ColorSwatchGraphics", AspectRatio -> 1, Frame -> True,
|
|
|
|
FrameStyle -> GrayLevel[0.33333333333333337`], FrameTicks ->
|
|
|
|
None, PlotRangePadding -> None, ImageSize ->
|
|
|
|
Dynamic[{
|
|
|
|
Automatic, 1.35 CurrentValue["FontCapHeight"]/
|
|
|
|
AbsoluteCurrentValue[Magnification]}]],
|
|
|
|
StyleBox[
|
|
|
|
RowBox[{"GrayLevel", "[", "0.5`", "]"}], NumberMarks ->
|
|
|
|
False]], Appearance -> None, BaseStyle -> {},
|
|
|
|
BaselinePosition -> Baseline, DefaultBaseStyle -> {},
|
|
|
|
ButtonFunction :> With[{Typeset`box$ = EvaluationBox[]},
|
|
|
|
If[
|
|
|
|
Not[
|
|
|
|
AbsoluteCurrentValue["Deployed"]],
|
|
|
|
SelectionMove[Typeset`box$, All, Expression];
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialAlpha = 1;
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialColor =
|
|
|
|
GrayLevel[0.5];
|
|
|
|
FrontEnd`Private`$ColorSelectorUseMakeBoxes = True;
|
|
|
|
MathLink`CallFrontEnd[
|
|
|
|
FrontEnd`AttachCell[Typeset`box$,
|
|
|
|
FrontEndResource["GrayLevelColorValueSelector"], {
|
|
|
|
0, {Left, Bottom}}, {Left, Top},
|
|
|
|
"ClosingActions" -> {
|
|
|
|
"SelectionDeparture", "ParentChanged",
|
|
|
|
"EvaluatorQuit"}]]]], BaseStyle -> Inherited, Evaluator ->
|
|
|
|
Automatic, Method -> "Preemptive"],
|
|
|
|
GrayLevel[0.5], Editable -> False, Selectable -> False]}],
|
|
|
|
"]"}]}], "}"}], ",",
|
|
|
|
RowBox[{"{",
|
|
|
|
RowBox[{#, ",", #2, ",", #3, ",", #4, ",", #5}], "}"}], ",",
|
|
|
|
RowBox[{"LegendMarkers", "\[Rule]",
|
|
|
|
RowBox[{"{",
|
|
|
|
RowBox[{
|
|
|
|
RowBox[{"{",
|
|
|
|
RowBox[{"False", ",", "Automatic"}], "}"}], ",",
|
|
|
|
RowBox[{"{",
|
|
|
|
RowBox[{"False", ",", "Automatic"}], "}"}], ",",
|
|
|
|
RowBox[{"{",
|
|
|
|
RowBox[{"False", ",", "Automatic"}], "}"}], ",",
|
|
|
|
RowBox[{"{",
|
|
|
|
RowBox[{"False", ",", "Automatic"}], "}"}], ",",
|
|
|
|
RowBox[{"{",
|
|
|
|
RowBox[{"False", ",", "Automatic"}], "}"}]}], "}"}]}], ",",
|
|
|
|
RowBox[{"Joined", "\[Rule]",
|
|
|
|
RowBox[{"{",
|
|
|
|
|
|
|
|
RowBox[{
|
|
|
|
"True", ",", "True", ",", "True", ",", "True", ",", "True"}],
|
|
|
|
"}"}]}], ",",
|
|
|
|
RowBox[{"LabelStyle", "\[Rule]",
|
|
|
|
RowBox[{"{",
|
|
|
|
RowBox[{"FontFamily", "\[Rule]", "\"Times\""}], "}"}]}], ",",
|
|
|
|
RowBox[{"LegendLayout", "\[Rule]", "\"Column\""}]}], "]"}]& )],
|
|
|
|
Scaled[{0.99, 0.99}], ImageScaled[{1, 1}],
|
|
|
|
BaseStyle->{FontSize -> Larger},
|
|
|
|
FormatType->StandardForm]},
|
|
|
|
AspectRatio->1,
|
|
|
|
Axes->{False, False},
|
|
|
|
AxesLabel->{None, None},
|
|
|
|
AxesOrigin->{1.1, -199.},
|
|
|
|
BaseStyle->18,
|
|
|
|
DisplayFunction->Identity,
|
|
|
|
Frame->{{True, True}, {True, True}},
|
|
|
|
FrameLabel->{{
|
|
|
|
FormBox[
|
|
|
|
StyleBox[
|
|
|
|
"\"\\!\\(\\*StyleBox[\\\"E\\\",FontSlant->\\\"Italic\\\"]\\)(F-F) \
|
|
|
|
(hartree)\"", FontSize -> 20, StripOnInput -> False], TraditionalForm],
|
|
|
|
None}, {
|
|
|
|
FormBox[
|
|
|
|
StyleBox[
|
|
|
|
"\"\\!\\(\\*SubscriptBox[\\(R\\), \\(F - F\\)]\\) (\[Angstrom])\"",
|
|
|
|
FontSize -> 20, StripOnInput -> False], TraditionalForm], None}},
|
|
|
|
FrameStyle->Automatic,
|
|
|
|
FrameTicks->{{Automatic, Automatic}, {Automatic, Automatic}},
|
|
|
|
GridLines->{Automatic, Automatic},
|
|
|
|
GridLinesStyle->Directive[
|
|
|
|
GrayLevel[0.5, 0.4]],
|
|
|
|
ImageSize->500,
|
|
|
|
LabelStyle->{FontFamily -> "Times"},
|
|
|
|
Method->{
|
|
|
|
"OptimizePlotMarkers" -> True, "OptimizePlotMarkers" -> True,
|
|
|
|
"CoordinatesToolOptions" -> {"DisplayFunction" -> ({
|
|
|
|
Identity[
|
|
|
|
Part[#, 1]],
|
|
|
|
Identity[
|
|
|
|
Part[#, 2]]}& ), "CopiedValueFunction" -> ({
|
|
|
|
Identity[
|
|
|
|
Part[#, 1]],
|
|
|
|
Identity[
|
|
|
|
Part[#, 2]]}& )}},
|
2022-04-25 14:17:16 +02:00
|
|
|
PlotRange->{{1.1, 1.65}, {-199.125, -199}},
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1.42878, -199.1097975546}, {1.4817, -199.1096214147}, {
|
|
|
|
1.53461, -199.1076633248}, {1.58753, -199.1045747396}, {
|
|
|
|
1.64045, -199.1008324508}, {1.69337, -199.0967858098}, {
|
|
|
|
1.74628, -199.0926887251}}]},
|
2022-04-22 11:43:01 +02:00
|
|
|
{RGBColor[1, 0, 0], PointSize[0.009166666666666668], Thickness[0.01],
|
2022-04-25 14:17:16 +02:00
|
|
|
CapForm["Butt"],
|
|
|
|
LineBox[{{1.1246157483711674`, -199.}, {1.16419, -199.0333451097}, {
|
|
|
|
1.21711, -199.0631340935}, {1.27002, -199.082113329}, {
|
|
|
|
1.32294, -199.0932285028}, {1.37586, -199.0986805911}, {
|
|
|
|
1.42878, -199.1001132928}, {1.4817, -199.0987420273}, {
|
|
|
|
1.53461, -199.095457527}, {1.58753, -199.090912857}, {
|
|
|
|
1.64045, -199.0855910885}, {1.69337, -199.0798534114}, {
|
|
|
|
1.74628, -199.073970804}}]},
|
2022-04-22 11:43:01 +02:00
|
|
|
{RGBColor[0, 0, 1], PointSize[0.009166666666666668], Thickness[0.01],
|
|
|
|
CapForm["Butt"], LineBox[CompressedData["
|
2022-04-25 14:17:16 +02:00
|
|
|
1:eJxTTMoPSmViYGAQB2IQHaLB1XH/zEd7BhB4kHEATDN8si8wVJ6ZCuSngcEn
|
|
|
|
e0+BtDbBhxkHzp4BgU/219JPX1kD5BuDwWf7sse8p9UfZRyYNRMEPttzTih8
|
|
|
|
2PkIZt4X+4uVOf43H8HM+2Iv+MOmUPgxzLwv9oFuG1V8H8PM+2qfGBLsU/oY
|
|
|
|
Zt5X+01JiaJdj2HmfbPncVdOnfwYZt43ex0WkfOL4OZ9s783KU9mA9y87/bb
|
|
|
|
JiTzbYKb991ePYWVdx3cvB/27NVREsvg5v2wX6agGjkZbt4P+/lT9n9rhJv3
|
|
|
|
03428+OUbLh5P+1PFTvsCYWb98v+rvpzVzu4eb/sV16/ul0eyAcAl5ux3w==
|
|
|
|
|
2022-04-22 11:43:01 +02:00
|
|
|
"]]},
|
|
|
|
{GrayLevel[0], PointSize[0.009166666666666668], Thickness[0.01],
|
|
|
|
CapForm["Butt"], LineBox[CompressedData["
|
2022-04-25 14:17:16 +02:00
|
|
|
1:eJxTTMoPSmViYGCQBGIQHdcm9sth/0d7BhB4kHEATDN8st/O9SqnBchPA4NP
|
|
|
|
9lOuGmW5Pcw4cPYMCHyyT5+x6ON9IN8YDD7bR09dczPsUcaBWTNB4LP9O76N
|
|
|
|
nTsfwcz7Yq9yZJYy12OYeV/sU8NVub0fw8z7Yt/7SeZd9WOYeV/tp+utuDf/
|
|
|
|
Mcy8r/Z6Dw5d2vkYZt43+wV2qn1n4OZ9sxdY81DmJty8b/arfBTz7sPN+27/
|
|
|
|
757psQdw877b37h6+84duHk/7Kd807pzA27eD/uGZ3NyL8DN+2G/+kX5hoNw
|
|
|
|
837amz1naN4CN++nvWndifVT4Ob9sj+bFa4dBzfvl72HDI9YEty8X/byOZWG
|
|
|
|
gXDzfts3nL9TZQbkAwChQM5D
|
2022-04-22 11:43:01 +02:00
|
|
|
"]]}}, {{}, {}}}, InsetBox[
|
|
|
|
TemplateBox[{
|
|
|
|
StyleBox["\"CC3\"", FontSize -> 20, StripOnInput -> False],
|
|
|
|
StyleBox["\"CCSD\"", FontSize -> 20, StripOnInput -> False],
|
|
|
|
StyleBox[
|
|
|
|
"\"BSE@\\!\\(\\*SubscriptBox[\\(G\\), \
|
2022-04-25 14:17:16 +02:00
|
|
|
\\(0\\)]\\)\\!\\(\\*SubscriptBox[\\(W\\), \\(0\\)]\\)@HF (\[Kappa] = 0 au)\"",
|
|
|
|
FontSize -> 20, StripOnInput -> False],
|
2022-04-22 11:43:01 +02:00
|
|
|
StyleBox[
|
|
|
|
"\"BSE@\\!\\(\\*SubscriptBox[\\(G\\), \
|
2022-04-25 14:17:16 +02:00
|
|
|
\\(0\\)]\\)\\!\\(\\*SubscriptBox[\\(W\\), \\(0\\)]\\)@HF (\[Kappa] = 0.1 \
|
|
|
|
au)\"", FontSize -> 20, StripOnInput -> False],
|
2022-04-22 11:43:01 +02:00
|
|
|
StyleBox[
|
2022-04-25 14:17:16 +02:00
|
|
|
"\"BSE@evGW@HF (\[Kappa] = 0.1 au)\"", FontSize -> 20, StripOnInput ->
|
2022-04-22 11:43:01 +02:00
|
|
|
False]},
|
|
|
|
"PointLegend",
|
|
|
|
DisplayFunction->(FormBox[
|
|
|
|
StyleBox[
|
|
|
|
StyleBox[
|
|
|
|
PaneBox[
|
|
|
|
TagBox[
|
|
|
|
GridBox[{{
|
|
|
|
TagBox[
|
|
|
|
GridBox[{{
|
|
|
|
GraphicsBox[{{
|
|
|
|
Directive[
|
|
|
|
EdgeForm[
|
|
|
|
Directive[
|
|
|
|
Opacity[0.3],
|
|
|
|
GrayLevel[0]]],
|
|
|
|
PointSize[0.5],
|
|
|
|
CapForm["Butt"],
|
|
|
|
AbsoluteThickness[1.6],
|
|
|
|
Thickness[0.18],
|
|
|
|
RGBColor[1, 0.5, 0]], {
|
|
|
|
LineBox[{{0, 10}, {20, 10}}]}}, {
|
|
|
|
Directive[
|
|
|
|
EdgeForm[
|
|
|
|
Directive[
|
|
|
|
Opacity[0.3],
|
|
|
|
GrayLevel[0]]],
|
|
|
|
PointSize[0.5],
|
|
|
|
CapForm["Butt"],
|
|
|
|
AbsoluteThickness[1.6],
|
|
|
|
Thickness[0.18],
|
|
|
|
RGBColor[1, 0.5, 0]], {}}}, AspectRatio -> Full,
|
|
|
|
ImageSize -> {20, 10}, PlotRangePadding -> None,
|
|
|
|
ImagePadding -> Automatic,
|
|
|
|
BaselinePosition -> (Scaled[0.1] -> Baseline)], #}, {
|
|
|
|
GraphicsBox[{{
|
|
|
|
Directive[
|
|
|
|
EdgeForm[
|
|
|
|
Directive[
|
|
|
|
Opacity[0.3],
|
|
|
|
GrayLevel[0]]],
|
|
|
|
PointSize[0.5],
|
|
|
|
CapForm["Butt"],
|
|
|
|
AbsoluteThickness[1.6],
|
|
|
|
Thickness[0.18],
|
|
|
|
RGBColor[1, 0, 0]], {
|
|
|
|
LineBox[{{0, 10}, {20, 10}}]}}, {
|
|
|
|
Directive[
|
|
|
|
EdgeForm[
|
|
|
|
Directive[
|
|
|
|
Opacity[0.3],
|
|
|
|
GrayLevel[0]]],
|
|
|
|
PointSize[0.5],
|
|
|
|
CapForm["Butt"],
|
|
|
|
AbsoluteThickness[1.6],
|
|
|
|
Thickness[0.18],
|
|
|
|
RGBColor[1, 0, 0]], {}}}, AspectRatio -> Full,
|
|
|
|
ImageSize -> {20, 10}, PlotRangePadding -> None,
|
|
|
|
ImagePadding -> Automatic,
|
|
|
|
BaselinePosition -> (Scaled[0.1] -> Baseline)], #2}, {
|
|
|
|
GraphicsBox[{{
|
|
|
|
Directive[
|
|
|
|
EdgeForm[
|
|
|
|
Directive[
|
|
|
|
Opacity[0.3],
|
|
|
|
GrayLevel[0]]],
|
|
|
|
PointSize[0.5],
|
|
|
|
CapForm["Butt"],
|
|
|
|
AbsoluteThickness[1.6],
|
|
|
|
Thickness[0.18],
|
|
|
|
RGBColor[0, 0, 1]], {
|
|
|
|
LineBox[{{0, 10}, {20, 10}}]}}, {
|
|
|
|
Directive[
|
|
|
|
EdgeForm[
|
|
|
|
Directive[
|
|
|
|
Opacity[0.3],
|
|
|
|
GrayLevel[0]]],
|
|
|
|
PointSize[0.5],
|
|
|
|
CapForm["Butt"],
|
|
|
|
AbsoluteThickness[1.6],
|
|
|
|
Thickness[0.18],
|
|
|
|
RGBColor[0, 0, 1]], {}}}, AspectRatio -> Full,
|
|
|
|
ImageSize -> {20, 10}, PlotRangePadding -> None,
|
|
|
|
ImagePadding -> Automatic,
|
|
|
|
BaselinePosition -> (Scaled[0.1] -> Baseline)], #3}, {
|
|
|
|
GraphicsBox[{{
|
|
|
|
Directive[
|
|
|
|
EdgeForm[
|
|
|
|
Directive[
|
|
|
|
Opacity[0.3],
|
|
|
|
GrayLevel[0]]],
|
|
|
|
PointSize[0.5],
|
|
|
|
CapForm["Butt"],
|
|
|
|
AbsoluteThickness[1.6],
|
|
|
|
Thickness[0.18],
|
|
|
|
GrayLevel[0]], {
|
|
|
|
LineBox[{{0, 10}, {20, 10}}]}}, {
|
|
|
|
Directive[
|
|
|
|
EdgeForm[
|
|
|
|
Directive[
|
|
|
|
Opacity[0.3],
|
|
|
|
GrayLevel[0]]],
|
|
|
|
PointSize[0.5],
|
|
|
|
CapForm["Butt"],
|
|
|
|
AbsoluteThickness[1.6],
|
|
|
|
Thickness[0.18],
|
|
|
|
GrayLevel[0]], {}}}, AspectRatio -> Full,
|
|
|
|
ImageSize -> {20, 10}, PlotRangePadding -> None,
|
|
|
|
ImagePadding -> Automatic,
|
|
|
|
BaselinePosition -> (Scaled[0.1] -> Baseline)], #4}},
|
|
|
|
GridBoxAlignment -> {
|
|
|
|
"Columns" -> {Center, Left}, "Rows" -> {{Baseline}}},
|
|
|
|
AutoDelete -> False,
|
|
|
|
GridBoxDividers -> {
|
|
|
|
"Columns" -> {{False}}, "Rows" -> {{False}}},
|
|
|
|
GridBoxItemSize -> {"Columns" -> {{All}}, "Rows" -> {{All}}},
|
|
|
|
GridBoxSpacings -> {
|
|
|
|
"Columns" -> {{0.5}}, "Rows" -> {{0.8}}}], "Grid"]}},
|
|
|
|
GridBoxAlignment -> {"Columns" -> {{Left}}, "Rows" -> {{Top}}},
|
|
|
|
AutoDelete -> False,
|
|
|
|
GridBoxItemSize -> {
|
|
|
|
"Columns" -> {{Automatic}}, "Rows" -> {{Automatic}}},
|
|
|
|
GridBoxSpacings -> {"Columns" -> {{1}}, "Rows" -> {{0}}}],
|
|
|
|
"Grid"], Alignment -> Left, AppearanceElements -> None,
|
|
|
|
ImageMargins -> {{5, 5}, {5, 5}}, ImageSizeAction ->
|
|
|
|
"ResizeToFit"], LineIndent -> 0, StripOnInput -> False], {
|
|
|
|
FontFamily -> "Times"}, Background -> Automatic, StripOnInput ->
|
|
|
|
False], TraditionalForm]& ),
|
|
|
|
Editable->True,
|
|
|
|
InterpretationFunction:>(RowBox[{"PointLegend", "[",
|
|
|
|
RowBox[{
|
|
|
|
RowBox[{"{",
|
|
|
|
RowBox[{
|
|
|
|
RowBox[{"Directive", "[",
|
|
|
|
RowBox[{
|
|
|
|
RowBox[{"PointSize", "[", "0.009166666666666668`", "]"}],
|
|
|
|
",",
|
|
|
|
RowBox[{"CapForm", "[", "\"Butt\"", "]"}], ",",
|
|
|
|
RowBox[{"AbsoluteThickness", "[", "1.6`", "]"}], ",",
|
|
|
|
RowBox[{"Thickness", "[", "0.01`", "]"}], ",",
|
|
|
|
InterpretationBox[
|
|
|
|
ButtonBox[
|
|
|
|
TooltipBox[
|
|
|
|
GraphicsBox[{{
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{0, 0}]}, {
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{1, -1}]}, {
|
|
|
|
RGBColor[1, 0.5, 0],
|
|
|
|
RectangleBox[{0, -1}, {2, 1}]}}, DefaultBaseStyle ->
|
|
|
|
"ColorSwatchGraphics", AspectRatio -> 1, Frame -> True,
|
|
|
|
FrameStyle ->
|
|
|
|
RGBColor[0.6666666666666666, 0.33333333333333337`, 0.],
|
|
|
|
FrameTicks -> None, PlotRangePadding -> None, ImageSize ->
|
|
|
|
Dynamic[{
|
|
|
|
Automatic, 1.35 CurrentValue["FontCapHeight"]/
|
|
|
|
AbsoluteCurrentValue[Magnification]}]],
|
|
|
|
StyleBox[
|
|
|
|
RowBox[{"RGBColor", "[",
|
|
|
|
RowBox[{"1", ",", "0.5`", ",", "0"}], "]"}], NumberMarks ->
|
|
|
|
False]], Appearance -> None, BaseStyle -> {},
|
|
|
|
BaselinePosition -> Baseline, DefaultBaseStyle -> {},
|
|
|
|
ButtonFunction :> With[{Typeset`box$ = EvaluationBox[]},
|
|
|
|
If[
|
|
|
|
Not[
|
|
|
|
AbsoluteCurrentValue["Deployed"]],
|
|
|
|
SelectionMove[Typeset`box$, All, Expression];
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialAlpha = 1;
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialColor =
|
|
|
|
RGBColor[1, 0.5, 0];
|
|
|
|
FrontEnd`Private`$ColorSelectorUseMakeBoxes = True;
|
|
|
|
MathLink`CallFrontEnd[
|
|
|
|
FrontEnd`AttachCell[Typeset`box$,
|
|
|
|
FrontEndResource["RGBColorValueSelector"], {
|
|
|
|
0, {Left, Bottom}}, {Left, Top},
|
|
|
|
"ClosingActions" -> {
|
|
|
|
"SelectionDeparture", "ParentChanged",
|
|
|
|
"EvaluatorQuit"}]]]], BaseStyle -> Inherited, Evaluator ->
|
|
|
|
Automatic, Method -> "Preemptive"],
|
|
|
|
RGBColor[1, 0.5, 0], Editable -> False, Selectable ->
|
|
|
|
False]}], "]"}], ",",
|
|
|
|
RowBox[{"Directive", "[",
|
|
|
|
RowBox[{
|
|
|
|
RowBox[{"PointSize", "[", "0.009166666666666668`", "]"}],
|
|
|
|
",",
|
|
|
|
RowBox[{"CapForm", "[", "\"Butt\"", "]"}], ",",
|
|
|
|
RowBox[{"AbsoluteThickness", "[", "1.6`", "]"}], ",",
|
|
|
|
RowBox[{"Thickness", "[", "0.01`", "]"}], ",",
|
|
|
|
InterpretationBox[
|
|
|
|
ButtonBox[
|
|
|
|
TooltipBox[
|
|
|
|
GraphicsBox[{{
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{0, 0}]}, {
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{1, -1}]}, {
|
|
|
|
RGBColor[1, 0, 0],
|
|
|
|
RectangleBox[{0, -1}, {2, 1}]}}, DefaultBaseStyle ->
|
|
|
|
"ColorSwatchGraphics", AspectRatio -> 1, Frame -> True,
|
|
|
|
FrameStyle -> RGBColor[0.6666666666666666, 0., 0.],
|
|
|
|
FrameTicks -> None, PlotRangePadding -> None, ImageSize ->
|
|
|
|
Dynamic[{
|
|
|
|
Automatic, 1.35 CurrentValue["FontCapHeight"]/
|
|
|
|
AbsoluteCurrentValue[Magnification]}]],
|
|
|
|
StyleBox[
|
|
|
|
RowBox[{"RGBColor", "[",
|
|
|
|
RowBox[{"1", ",", "0", ",", "0"}], "]"}], NumberMarks ->
|
|
|
|
False]], Appearance -> None, BaseStyle -> {},
|
|
|
|
BaselinePosition -> Baseline, DefaultBaseStyle -> {},
|
|
|
|
ButtonFunction :> With[{Typeset`box$ = EvaluationBox[]},
|
|
|
|
If[
|
|
|
|
Not[
|
|
|
|
AbsoluteCurrentValue["Deployed"]],
|
|
|
|
SelectionMove[Typeset`box$, All, Expression];
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialAlpha = 1;
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialColor =
|
|
|
|
RGBColor[1, 0, 0];
|
|
|
|
FrontEnd`Private`$ColorSelectorUseMakeBoxes = True;
|
|
|
|
MathLink`CallFrontEnd[
|
|
|
|
FrontEnd`AttachCell[Typeset`box$,
|
|
|
|
FrontEndResource["RGBColorValueSelector"], {
|
|
|
|
0, {Left, Bottom}}, {Left, Top},
|
|
|
|
"ClosingActions" -> {
|
|
|
|
"SelectionDeparture", "ParentChanged",
|
|
|
|
"EvaluatorQuit"}]]]], BaseStyle -> Inherited, Evaluator ->
|
|
|
|
Automatic, Method -> "Preemptive"],
|
|
|
|
RGBColor[1, 0, 0], Editable -> False, Selectable ->
|
|
|
|
False]}], "]"}], ",",
|
|
|
|
RowBox[{"Directive", "[",
|
|
|
|
RowBox[{
|
|
|
|
RowBox[{"PointSize", "[", "0.009166666666666668`", "]"}],
|
|
|
|
",",
|
|
|
|
RowBox[{"CapForm", "[", "\"Butt\"", "]"}], ",",
|
|
|
|
RowBox[{"AbsoluteThickness", "[", "1.6`", "]"}], ",",
|
|
|
|
RowBox[{"Thickness", "[", "0.01`", "]"}], ",",
|
|
|
|
InterpretationBox[
|
|
|
|
ButtonBox[
|
|
|
|
TooltipBox[
|
|
|
|
GraphicsBox[{{
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{0, 0}]}, {
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{1, -1}]}, {
|
|
|
|
RGBColor[0, 0, 1],
|
|
|
|
RectangleBox[{0, -1}, {2, 1}]}}, DefaultBaseStyle ->
|
|
|
|
"ColorSwatchGraphics", AspectRatio -> 1, Frame -> True,
|
|
|
|
FrameStyle -> RGBColor[0., 0., 0.6666666666666666],
|
|
|
|
FrameTicks -> None, PlotRangePadding -> None, ImageSize ->
|
|
|
|
Dynamic[{
|
|
|
|
Automatic, 1.35 CurrentValue["FontCapHeight"]/
|
|
|
|
AbsoluteCurrentValue[Magnification]}]],
|
|
|
|
StyleBox[
|
|
|
|
RowBox[{"RGBColor", "[",
|
|
|
|
RowBox[{"0", ",", "0", ",", "1"}], "]"}], NumberMarks ->
|
|
|
|
False]], Appearance -> None, BaseStyle -> {},
|
|
|
|
BaselinePosition -> Baseline, DefaultBaseStyle -> {},
|
|
|
|
ButtonFunction :> With[{Typeset`box$ = EvaluationBox[]},
|
|
|
|
If[
|
|
|
|
Not[
|
|
|
|
AbsoluteCurrentValue["Deployed"]],
|
|
|
|
SelectionMove[Typeset`box$, All, Expression];
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialAlpha = 1;
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialColor =
|
|
|
|
RGBColor[0, 0, 1];
|
|
|
|
FrontEnd`Private`$ColorSelectorUseMakeBoxes = True;
|
|
|
|
MathLink`CallFrontEnd[
|
|
|
|
FrontEnd`AttachCell[Typeset`box$,
|
|
|
|
FrontEndResource["RGBColorValueSelector"], {
|
|
|
|
0, {Left, Bottom}}, {Left, Top},
|
|
|
|
"ClosingActions" -> {
|
|
|
|
"SelectionDeparture", "ParentChanged",
|
|
|
|
"EvaluatorQuit"}]]]], BaseStyle -> Inherited, Evaluator ->
|
|
|
|
Automatic, Method -> "Preemptive"],
|
|
|
|
RGBColor[0, 0, 1], Editable -> False, Selectable ->
|
|
|
|
False]}], "]"}], ",",
|
|
|
|
RowBox[{"Directive", "[",
|
|
|
|
RowBox[{
|
|
|
|
RowBox[{"PointSize", "[", "0.009166666666666668`", "]"}],
|
|
|
|
",",
|
|
|
|
RowBox[{"CapForm", "[", "\"Butt\"", "]"}], ",",
|
|
|
|
RowBox[{"AbsoluteThickness", "[", "1.6`", "]"}], ",",
|
|
|
|
RowBox[{"Thickness", "[", "0.01`", "]"}], ",",
|
|
|
|
InterpretationBox[
|
|
|
|
ButtonBox[
|
|
|
|
TooltipBox[
|
|
|
|
GraphicsBox[{{
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{0, 0}]}, {
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{1, -1}]}, {
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{0, -1}, {2, 1}]}}, DefaultBaseStyle ->
|
|
|
|
"ColorSwatchGraphics", AspectRatio -> 1, Frame -> True,
|
|
|
|
FrameStyle -> GrayLevel[0.], FrameTicks -> None,
|
|
|
|
PlotRangePadding -> None, ImageSize ->
|
|
|
|
Dynamic[{
|
|
|
|
Automatic, 1.35 CurrentValue["FontCapHeight"]/
|
|
|
|
AbsoluteCurrentValue[Magnification]}]],
|
|
|
|
StyleBox[
|
|
|
|
RowBox[{"GrayLevel", "[", "0", "]"}], NumberMarks ->
|
|
|
|
False]], Appearance -> None, BaseStyle -> {},
|
|
|
|
BaselinePosition -> Baseline, DefaultBaseStyle -> {},
|
|
|
|
ButtonFunction :> With[{Typeset`box$ = EvaluationBox[]},
|
|
|
|
If[
|
|
|
|
Not[
|
|
|
|
AbsoluteCurrentValue["Deployed"]],
|
|
|
|
SelectionMove[Typeset`box$, All, Expression];
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialAlpha = 1;
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialColor =
|
|
|
|
GrayLevel[0];
|
|
|
|
FrontEnd`Private`$ColorSelectorUseMakeBoxes = True;
|
|
|
|
MathLink`CallFrontEnd[
|
|
|
|
FrontEnd`AttachCell[Typeset`box$,
|
|
|
|
FrontEndResource["GrayLevelColorValueSelector"], {
|
|
|
|
0, {Left, Bottom}}, {Left, Top},
|
|
|
|
"ClosingActions" -> {
|
|
|
|
"SelectionDeparture", "ParentChanged",
|
|
|
|
"EvaluatorQuit"}]]]], BaseStyle -> Inherited, Evaluator ->
|
|
|
|
Automatic, Method -> "Preemptive"],
|
|
|
|
GrayLevel[0], Editable -> False, Selectable -> False]}],
|
|
|
|
"]"}]}], "}"}], ",",
|
|
|
|
RowBox[{"{",
|
|
|
|
RowBox[{#, ",", #2, ",", #3, ",", #4, ",", #5}], "}"}], ",",
|
|
|
|
RowBox[{"LegendMarkers", "\[Rule]",
|
|
|
|
RowBox[{"{",
|
|
|
|
RowBox[{
|
|
|
|
RowBox[{"{",
|
|
|
|
RowBox[{"False", ",", "Automatic"}], "}"}], ",",
|
|
|
|
RowBox[{"{",
|
|
|
|
RowBox[{"False", ",", "Automatic"}], "}"}], ",",
|
|
|
|
RowBox[{"{",
|
|
|
|
RowBox[{"False", ",", "Automatic"}], "}"}], ",",
|
|
|
|
RowBox[{"{",
|
|
|
|
RowBox[{"False", ",", "Automatic"}], "}"}]}], "}"}]}], ",",
|
|
|
|
RowBox[{"Joined", "\[Rule]",
|
|
|
|
RowBox[{"{",
|
|
|
|
RowBox[{"True", ",", "True", ",", "True", ",", "True"}],
|
|
|
|
"}"}]}], ",",
|
|
|
|
RowBox[{"LabelStyle", "\[Rule]",
|
|
|
|
RowBox[{"{",
|
|
|
|
RowBox[{"FontFamily", "\[Rule]", "\"Times\""}], "}"}]}], ",",
|
|
|
|
RowBox[{"LegendLayout", "\[Rule]", "\"Column\""}]}], "]"}]& )],
|
|
|
|
Scaled[{0.99, 0.99}], ImageScaled[{1, 1}],
|
|
|
|
BaseStyle->{FontSize -> Larger},
|
|
|
|
FormatType->StandardForm]},
|
|
|
|
AspectRatio->1,
|
|
|
|
Axes->{False, False},
|
|
|
|
AxesLabel->{None, None},
|
|
|
|
AxesOrigin->{1.1, -199.},
|
|
|
|
BaseStyle->18,
|
|
|
|
DisplayFunction->Identity,
|
|
|
|
Frame->{{True, True}, {True, True}},
|
|
|
|
FrameLabel->{{
|
|
|
|
FormBox[
|
|
|
|
StyleBox[
|
|
|
|
"\"\\!\\(\\*StyleBox[\\\"E\\\",FontSlant->\\\"Italic\\\"]\\)(F-F) \
|
|
|
|
(hartree)\"", FontSize -> 20, StripOnInput -> False], TraditionalForm],
|
|
|
|
None}, {
|
|
|
|
FormBox[
|
|
|
|
StyleBox[
|
|
|
|
"\"\\!\\(\\*SubscriptBox[\\(R\\), \\(F - F\\)]\\) (\[Angstrom])\"",
|
|
|
|
FontSize -> 20, StripOnInput -> False], TraditionalForm], None}},
|
|
|
|
FrameStyle->Automatic,
|
|
|
|
FrameTicks->{{Automatic, Automatic}, {Automatic, Automatic}},
|
|
|
|
GridLines->{Automatic, Automatic},
|
|
|
|
GridLinesStyle->Directive[
|
|
|
|
GrayLevel[0.5, 0.4]],
|
|
|
|
ImageSize->500,
|
|
|
|
LabelStyle->{FontFamily -> "Times"},
|
|
|
|
Method->{
|
|
|
|
"OptimizePlotMarkers" -> True, "OptimizePlotMarkers" -> True,
|
|
|
|
"CoordinatesToolOptions" -> {"DisplayFunction" -> ({
|
|
|
|
Identity[
|
|
|
|
Part[#, 1]],
|
|
|
|
Identity[
|
|
|
|
Part[#, 2]]}& ), "CopiedValueFunction" -> ({
|
|
|
|
Identity[
|
|
|
|
Part[#, 1]],
|
|
|
|
Identity[
|
|
|
|
Part[#, 2]]}& )}},
|
2022-04-25 14:17:16 +02:00
|
|
|
PlotRange->{{1.1, 1.65}, {-199.125, -199}},
|
2022-04-22 11:43:01 +02:00
|
|
|
PlotRangeClipping->True,
|
|
|
|
PlotRangePadding->{{0, 0}, {0, 0}},
|
|
|
|
Ticks->{Automatic, Automatic}],
|
|
|
|
InterpretTemplate[Legended[
|
|
|
|
Graphics[{{}, {{{}, {}, {
|
|
|
|
Hue[0.67, 0.6, 0.6],
|
|
|
|
Directive[
|
|
|
|
PointSize[0.009166666666666668],
|
|
|
|
CapForm["Butt"],
|
|
|
|
AbsoluteThickness[1.6],
|
|
|
|
Thickness[0.01],
|
|
|
|
RGBColor[1, 0.5, 0]],
|
2022-04-25 14:17:16 +02:00
|
|
|
Line[{{1.1186000920834196`, -199.}, {1.16419, -199.0388640823}, {
|
|
|
|
1.21711, -199.0692686079}, {1.27002, -199.0889640392}, {
|
|
|
|
1.32294, -199.1009044038}, {1.37586, -199.1072986871}, {
|
|
|
|
1.42878, -199.1097975546}, {1.4817, -199.1096214147}, {
|
|
|
|
1.53461, -199.1076633248}, {1.58753, -199.1045747396}, {
|
|
|
|
1.64045, -199.1008324508}, {1.69337, -199.0967858098}, {
|
|
|
|
1.74628, -199.0926887251}}]}, {
|
2022-04-22 11:43:01 +02:00
|
|
|
Hue[0.9060679774997897, 0.6, 0.6],
|
|
|
|
Directive[
|
|
|
|
PointSize[0.009166666666666668],
|
|
|
|
CapForm["Butt"],
|
|
|
|
AbsoluteThickness[1.6],
|
|
|
|
Thickness[0.01],
|
|
|
|
RGBColor[1, 0, 0]],
|
2022-04-25 14:17:16 +02:00
|
|
|
Line[{{1.1246157483711674`, -199.}, {1.16419, -199.0333451097}, {
|
|
|
|
1.21711, -199.0631340935}, {1.27002, -199.082113329}, {
|
|
|
|
1.32294, -199.0932285028}, {1.37586, -199.0986805911}, {
|
|
|
|
1.42878, -199.1001132928}, {1.4817, -199.0987420273}, {
|
|
|
|
1.53461, -199.095457527}, {1.58753, -199.090912857}, {
|
|
|
|
1.64045, -199.0855910885}, {1.69337, -199.0798534114}, {
|
|
|
|
1.74628, -199.073970804}}]}, {
|
2022-04-22 11:43:01 +02:00
|
|
|
Hue[0.1421359549995791, 0.6, 0.6],
|
|
|
|
Directive[
|
|
|
|
PointSize[0.009166666666666668],
|
|
|
|
CapForm["Butt"],
|
|
|
|
AbsoluteThickness[1.6],
|
|
|
|
Thickness[0.01],
|
|
|
|
RGBColor[0, 0, 1]],
|
|
|
|
Line[CompressedData["
|
2022-04-25 14:17:16 +02:00
|
|
|
1:eJxTTMoPSmViYGAQB2IQHaLB1XH/zEd7BhB4kHEATDN8si8wVJ6ZCuSngcEn
|
|
|
|
e0+BtDbBhxkHzp4BgU/219JPX1kD5BuDwWf7sse8p9UfZRyYNRMEPttzTih8
|
|
|
|
2PkIZt4X+4uVOf43H8HM+2Iv+MOmUPgxzLwv9oFuG1V8H8PM+2qfGBLsU/oY
|
|
|
|
Zt5X+01JiaJdj2HmfbPncVdOnfwYZt43ex0WkfOL4OZ9s783KU9mA9y87/bb
|
|
|
|
JiTzbYKb991ePYWVdx3cvB/27NVREsvg5v2wX6agGjkZbt4P+/lT9n9rhJv3
|
|
|
|
03428+OUbLh5P+1PFTvsCYWb98v+rvpzVzu4eb/sV16/ul0eyAcAl5ux3w==
|
|
|
|
|
2022-04-22 11:43:01 +02:00
|
|
|
"]]}, {
|
|
|
|
Hue[0.37820393249936934`, 0.6, 0.6],
|
|
|
|
Directive[
|
|
|
|
PointSize[0.009166666666666668],
|
|
|
|
CapForm["Butt"],
|
|
|
|
AbsoluteThickness[1.6],
|
|
|
|
Thickness[0.01],
|
|
|
|
GrayLevel[0]],
|
|
|
|
Line[CompressedData["
|
2022-04-25 14:17:16 +02:00
|
|
|
1:eJxTTMoPSmViYGCQBGIQHdcm9sth/0d7BhB4kHEATDN8st/O9SqnBchPA4NP
|
|
|
|
9lOuGmW5Pcw4cPYMCHyyT5+x6ON9IN8YDD7bR09dczPsUcaBWTNB4LP9O76N
|
|
|
|
nTsfwcz7Yq9yZJYy12OYeV/sU8NVub0fw8z7Yt/7SeZd9WOYeV/tp+utuDf/
|
|
|
|
Mcy8r/Z6Dw5d2vkYZt43+wV2qn1n4OZ9sxdY81DmJty8b/arfBTz7sPN+27/
|
|
|
|
757psQdw877b37h6+84duHk/7Kd807pzA27eD/uGZ3NyL8DN+2G/+kX5hoNw
|
|
|
|
837amz1naN4CN++nvWndifVT4Ob9sj+bFa4dBzfvl72HDI9YEty8X/byOZWG
|
|
|
|
gXDzfts3nL9TZQbkAwChQM5D
|
2022-04-22 11:43:01 +02:00
|
|
|
"]]}}}, {{}, {}}}, {
|
|
|
|
DisplayFunction -> Identity, DisplayFunction -> Identity, AspectRatio ->
|
|
|
|
1, Axes -> {False, False}, AxesLabel -> {None, None},
|
|
|
|
AxesOrigin -> {1.1, -199.}, BaseStyle -> 18, DisplayFunction :>
|
|
|
|
Identity, Frame -> {{True, True}, {True, True}}, FrameLabel -> {{
|
|
|
|
Style[
|
|
|
|
"\!\(\*StyleBox[\"E\",FontSlant->\"Italic\"]\)(F-F) (hartree)",
|
|
|
|
FontSize -> 20], None}, {
|
|
|
|
Style[
|
|
|
|
"\!\(\*SubscriptBox[\(R\), \(F - F\)]\) (\[Angstrom])", FontSize ->
|
|
|
|
20], None}}, FrameStyle -> Automatic,
|
|
|
|
FrameTicks -> {{Automatic, Automatic}, {Automatic, Automatic}},
|
|
|
|
GridLines -> {Automatic, Automatic}, GridLinesStyle -> Directive[
|
|
|
|
GrayLevel[0.5, 0.4]], ImageSize -> 500,
|
|
|
|
LabelStyle -> {FontFamily -> "Times"},
|
|
|
|
Method -> {
|
|
|
|
"OptimizePlotMarkers" -> True, "OptimizePlotMarkers" -> True,
|
|
|
|
"CoordinatesToolOptions" -> {"DisplayFunction" -> ({
|
|
|
|
Identity[
|
|
|
|
Part[#, 1]],
|
|
|
|
Identity[
|
|
|
|
Part[#, 2]]}& ), "CopiedValueFunction" -> ({
|
|
|
|
Identity[
|
|
|
|
Part[#, 1]],
|
|
|
|
Identity[
|
2022-04-25 14:17:16 +02:00
|
|
|
Part[#, 2]]}& )}}, PlotRange -> {{1.1, 1.65}, {-199.125, -199}},
|
2022-04-22 11:43:01 +02:00
|
|
|
PlotRangeClipping -> True, PlotRangePadding -> {{0, 0}, {0, 0}},
|
|
|
|
Ticks -> {Automatic, Automatic}}],
|
|
|
|
Placed[
|
|
|
|
Unevaluated[
|
|
|
|
PointLegend[{
|
|
|
|
Directive[
|
|
|
|
PointSize[0.009166666666666668],
|
|
|
|
CapForm["Butt"],
|
|
|
|
AbsoluteThickness[1.6],
|
|
|
|
Thickness[0.01],
|
|
|
|
RGBColor[1, 0.5, 0]],
|
|
|
|
Directive[
|
|
|
|
PointSize[0.009166666666666668],
|
|
|
|
CapForm["Butt"],
|
|
|
|
AbsoluteThickness[1.6],
|
|
|
|
Thickness[0.01],
|
|
|
|
RGBColor[1, 0, 0]],
|
|
|
|
Directive[
|
|
|
|
PointSize[0.009166666666666668],
|
|
|
|
CapForm["Butt"],
|
|
|
|
AbsoluteThickness[1.6],
|
|
|
|
Thickness[0.01],
|
|
|
|
RGBColor[0, 0, 1]],
|
|
|
|
Directive[
|
|
|
|
PointSize[0.009166666666666668],
|
|
|
|
CapForm["Butt"],
|
|
|
|
AbsoluteThickness[1.6],
|
|
|
|
Thickness[0.01],
|
|
|
|
GrayLevel[0]]}, {
|
|
|
|
Style["CC3", FontSize -> 20],
|
|
|
|
Style["CCSD", FontSize -> 20],
|
|
|
|
Style[
|
|
|
|
"BSE@\!\(\*SubscriptBox[\(G\), \(0\)]\)\!\(\*SubscriptBox[\(W\), \
|
2022-04-25 14:17:16 +02:00
|
|
|
\(0\)]\)@HF (\[Kappa] = 0 au)", FontSize -> 20],
|
2022-04-22 11:43:01 +02:00
|
|
|
Style[
|
|
|
|
"BSE@\!\(\*SubscriptBox[\(G\), \(0\)]\)\!\(\*SubscriptBox[\(W\), \
|
2022-04-25 14:17:16 +02:00
|
|
|
\(0\)]\)@HF (\[Kappa] = 0.1 au)", FontSize -> 20],
|
|
|
|
Style["BSE@evGW@HF (\[Kappa] = 0.1 au)", FontSize -> 20]},
|
2022-04-22 11:43:01 +02:00
|
|
|
LegendMarkers -> {{False, Automatic}, {False, Automatic}, {
|
|
|
|
False, Automatic}, {False, Automatic}},
|
|
|
|
Joined -> {True, True, True, True},
|
|
|
|
LabelStyle -> {FontFamily -> "Times"}, LegendLayout -> "Column"]], {
|
|
|
|
Right, Top}, Identity]]& ],
|
|
|
|
AutoDelete->True,
|
|
|
|
Editable->True,
|
|
|
|
SelectWithContents->False,
|
|
|
|
Selectable->True]], "Output",
|
|
|
|
CellChangeTimes->{
|
|
|
|
3.85953970068469*^9, {3.859605814742634*^9, 3.8596058777011337`*^9}, {
|
2022-04-25 14:17:16 +02:00
|
|
|
3.859605916383668*^9, 3.8596059366174793`*^9}, 3.859876759794423*^9},
|
2022-04-22 11:43:01 +02:00
|
|
|
CellLabel->
|
2022-04-25 14:17:16 +02:00
|
|
|
"Out[3572]=",ExpressionUUID->"91b903be-96d6-43ce-9ed3-b6d406dd0fca"]
|
2022-04-22 11:43:01 +02:00
|
|
|
}, Open ]]
|
|
|
|
}, Open ]],
|
|
|
|
|
|
|
|
Cell[CellGroupData[{
|
|
|
|
|
|
|
|
Cell["\[Kappa] = 1", "Subsection",
|
|
|
|
CellChangeTimes->{{3.859518592036785*^9, 3.8595186072182293`*^9}, {
|
|
|
|
3.859518845056589*^9, 3.859518845185258*^9}, 3.859518898476948*^9, {
|
|
|
|
3.8596057877332706`*^9, 3.8596057917613583`*^9},
|
|
|
|
3.859605836148402*^9},ExpressionUUID->"dcd27f4a-b467-4baa-b0e4-\
|
|
|
|
52959dd6f7c7"],
|
|
|
|
|
|
|
|
Cell[CellGroupData[{
|
|
|
|
|
|
|
|
Cell[BoxData[
|
|
|
|
RowBox[{"ListPlot", "[",
|
|
|
|
RowBox[{
|
|
|
|
RowBox[{"{", "\[IndentingNewLine]",
|
|
|
|
RowBox[{
|
|
|
|
"cc3", ",", "ccsd", ",", "g0w0", ",", "kappa1g0w0", ",", "kappa1evgw"}],
|
|
|
|
"\[IndentingNewLine]", "}"}], ",", "\[IndentingNewLine]",
|
|
|
|
RowBox[{"FrameLabel", "\[Rule]",
|
|
|
|
RowBox[{"{", "\[IndentingNewLine]",
|
|
|
|
RowBox[{
|
|
|
|
RowBox[{"Style", "[",
|
|
|
|
RowBox[{
|
|
|
|
"\"\<\!\(\*SubscriptBox[\(R\), \(F - F\)]\) (\[Angstrom])\>\"", ",",
|
|
|
|
RowBox[{"FontSize", "\[Rule]", "SizeLabel"}]}], "]"}], ",",
|
|
|
|
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|
|
RowBox[{"PointSize", "[", "0.009166666666666668`", "]"}],
|
|
|
|
",",
|
|
|
|
RowBox[{"CapForm", "[", "\"Butt\"", "]"}], ",",
|
|
|
|
RowBox[{"AbsoluteThickness", "[", "1.6`", "]"}], ",",
|
|
|
|
RowBox[{"Thickness", "[", "0.01`", "]"}], ",",
|
|
|
|
InterpretationBox[
|
|
|
|
ButtonBox[
|
|
|
|
TooltipBox[
|
|
|
|
GraphicsBox[{{
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{0, 0}]}, {
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{1, -1}]}, {
|
|
|
|
RGBColor[1, 0.5, 0],
|
|
|
|
RectangleBox[{0, -1}, {2, 1}]}}, DefaultBaseStyle ->
|
|
|
|
"ColorSwatchGraphics", AspectRatio -> 1, Frame -> True,
|
|
|
|
FrameStyle ->
|
|
|
|
RGBColor[0.6666666666666666, 0.33333333333333337`, 0.],
|
|
|
|
FrameTicks -> None, PlotRangePadding -> None, ImageSize ->
|
|
|
|
Dynamic[{
|
|
|
|
Automatic, 1.35 CurrentValue["FontCapHeight"]/
|
|
|
|
AbsoluteCurrentValue[Magnification]}]],
|
|
|
|
StyleBox[
|
|
|
|
RowBox[{"RGBColor", "[",
|
|
|
|
RowBox[{"1", ",", "0.5`", ",", "0"}], "]"}], NumberMarks ->
|
|
|
|
False]], Appearance -> None, BaseStyle -> {},
|
|
|
|
BaselinePosition -> Baseline, DefaultBaseStyle -> {},
|
|
|
|
ButtonFunction :> With[{Typeset`box$ = EvaluationBox[]},
|
|
|
|
If[
|
|
|
|
Not[
|
|
|
|
AbsoluteCurrentValue["Deployed"]],
|
|
|
|
SelectionMove[Typeset`box$, All, Expression];
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialAlpha = 1;
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialColor =
|
|
|
|
RGBColor[1, 0.5, 0];
|
|
|
|
FrontEnd`Private`$ColorSelectorUseMakeBoxes = True;
|
|
|
|
MathLink`CallFrontEnd[
|
|
|
|
FrontEnd`AttachCell[Typeset`box$,
|
|
|
|
FrontEndResource["RGBColorValueSelector"], {
|
|
|
|
0, {Left, Bottom}}, {Left, Top},
|
|
|
|
"ClosingActions" -> {
|
|
|
|
"SelectionDeparture", "ParentChanged",
|
|
|
|
"EvaluatorQuit"}]]]], BaseStyle -> Inherited, Evaluator ->
|
|
|
|
Automatic, Method -> "Preemptive"],
|
|
|
|
RGBColor[1, 0.5, 0], Editable -> False, Selectable ->
|
|
|
|
False]}], "]"}], ",",
|
|
|
|
RowBox[{"Directive", "[",
|
|
|
|
RowBox[{
|
|
|
|
RowBox[{"PointSize", "[", "0.009166666666666668`", "]"}],
|
|
|
|
",",
|
|
|
|
RowBox[{"CapForm", "[", "\"Butt\"", "]"}], ",",
|
|
|
|
RowBox[{"AbsoluteThickness", "[", "1.6`", "]"}], ",",
|
|
|
|
RowBox[{"Thickness", "[", "0.01`", "]"}], ",",
|
|
|
|
InterpretationBox[
|
|
|
|
ButtonBox[
|
|
|
|
TooltipBox[
|
|
|
|
GraphicsBox[{{
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{0, 0}]}, {
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{1, -1}]}, {
|
|
|
|
RGBColor[1, 0, 0],
|
|
|
|
RectangleBox[{0, -1}, {2, 1}]}}, DefaultBaseStyle ->
|
|
|
|
"ColorSwatchGraphics", AspectRatio -> 1, Frame -> True,
|
|
|
|
FrameStyle -> RGBColor[0.6666666666666666, 0., 0.],
|
|
|
|
FrameTicks -> None, PlotRangePadding -> None, ImageSize ->
|
|
|
|
Dynamic[{
|
|
|
|
Automatic, 1.35 CurrentValue["FontCapHeight"]/
|
|
|
|
AbsoluteCurrentValue[Magnification]}]],
|
|
|
|
StyleBox[
|
|
|
|
RowBox[{"RGBColor", "[",
|
|
|
|
RowBox[{"1", ",", "0", ",", "0"}], "]"}], NumberMarks ->
|
|
|
|
False]], Appearance -> None, BaseStyle -> {},
|
|
|
|
BaselinePosition -> Baseline, DefaultBaseStyle -> {},
|
|
|
|
ButtonFunction :> With[{Typeset`box$ = EvaluationBox[]},
|
|
|
|
If[
|
|
|
|
Not[
|
|
|
|
AbsoluteCurrentValue["Deployed"]],
|
|
|
|
SelectionMove[Typeset`box$, All, Expression];
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialAlpha = 1;
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialColor =
|
|
|
|
RGBColor[1, 0, 0];
|
|
|
|
FrontEnd`Private`$ColorSelectorUseMakeBoxes = True;
|
|
|
|
MathLink`CallFrontEnd[
|
|
|
|
FrontEnd`AttachCell[Typeset`box$,
|
|
|
|
FrontEndResource["RGBColorValueSelector"], {
|
|
|
|
0, {Left, Bottom}}, {Left, Top},
|
|
|
|
"ClosingActions" -> {
|
|
|
|
"SelectionDeparture", "ParentChanged",
|
|
|
|
"EvaluatorQuit"}]]]], BaseStyle -> Inherited, Evaluator ->
|
|
|
|
Automatic, Method -> "Preemptive"],
|
|
|
|
RGBColor[1, 0, 0], Editable -> False, Selectable ->
|
|
|
|
False]}], "]"}], ",",
|
|
|
|
RowBox[{"Directive", "[",
|
|
|
|
RowBox[{
|
|
|
|
RowBox[{"PointSize", "[", "0.009166666666666668`", "]"}],
|
|
|
|
",",
|
|
|
|
RowBox[{"CapForm", "[", "\"Butt\"", "]"}], ",",
|
|
|
|
RowBox[{"AbsoluteThickness", "[", "1.6`", "]"}], ",",
|
|
|
|
RowBox[{"Thickness", "[", "0.01`", "]"}], ",",
|
|
|
|
InterpretationBox[
|
|
|
|
ButtonBox[
|
|
|
|
TooltipBox[
|
|
|
|
GraphicsBox[{{
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{0, 0}]}, {
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{1, -1}]}, {
|
|
|
|
RGBColor[0, 0, 1],
|
|
|
|
RectangleBox[{0, -1}, {2, 1}]}}, DefaultBaseStyle ->
|
|
|
|
"ColorSwatchGraphics", AspectRatio -> 1, Frame -> True,
|
|
|
|
FrameStyle -> RGBColor[0., 0., 0.6666666666666666],
|
|
|
|
FrameTicks -> None, PlotRangePadding -> None, ImageSize ->
|
|
|
|
Dynamic[{
|
|
|
|
Automatic, 1.35 CurrentValue["FontCapHeight"]/
|
|
|
|
AbsoluteCurrentValue[Magnification]}]],
|
|
|
|
StyleBox[
|
|
|
|
RowBox[{"RGBColor", "[",
|
|
|
|
RowBox[{"0", ",", "0", ",", "1"}], "]"}], NumberMarks ->
|
|
|
|
False]], Appearance -> None, BaseStyle -> {},
|
|
|
|
BaselinePosition -> Baseline, DefaultBaseStyle -> {},
|
|
|
|
ButtonFunction :> With[{Typeset`box$ = EvaluationBox[]},
|
|
|
|
If[
|
|
|
|
Not[
|
|
|
|
AbsoluteCurrentValue["Deployed"]],
|
|
|
|
SelectionMove[Typeset`box$, All, Expression];
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialAlpha = 1;
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialColor =
|
|
|
|
RGBColor[0, 0, 1];
|
|
|
|
FrontEnd`Private`$ColorSelectorUseMakeBoxes = True;
|
|
|
|
MathLink`CallFrontEnd[
|
|
|
|
FrontEnd`AttachCell[Typeset`box$,
|
|
|
|
FrontEndResource["RGBColorValueSelector"], {
|
|
|
|
0, {Left, Bottom}}, {Left, Top},
|
|
|
|
"ClosingActions" -> {
|
|
|
|
"SelectionDeparture", "ParentChanged",
|
|
|
|
"EvaluatorQuit"}]]]], BaseStyle -> Inherited, Evaluator ->
|
|
|
|
Automatic, Method -> "Preemptive"],
|
|
|
|
RGBColor[0, 0, 1], Editable -> False, Selectable ->
|
|
|
|
False]}], "]"}], ",",
|
|
|
|
RowBox[{"Directive", "[",
|
|
|
|
RowBox[{
|
|
|
|
RowBox[{"PointSize", "[", "0.009166666666666668`", "]"}],
|
|
|
|
",",
|
|
|
|
RowBox[{"CapForm", "[", "\"Butt\"", "]"}], ",",
|
|
|
|
RowBox[{"AbsoluteThickness", "[", "1.6`", "]"}], ",",
|
|
|
|
RowBox[{"Thickness", "[", "0.01`", "]"}], ",",
|
|
|
|
InterpretationBox[
|
|
|
|
ButtonBox[
|
|
|
|
TooltipBox[
|
|
|
|
GraphicsBox[{{
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{0, 0}]}, {
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{1, -1}]}, {
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{0, -1}, {2, 1}]}}, DefaultBaseStyle ->
|
|
|
|
"ColorSwatchGraphics", AspectRatio -> 1, Frame -> True,
|
|
|
|
FrameStyle -> GrayLevel[0.], FrameTicks -> None,
|
|
|
|
PlotRangePadding -> None, ImageSize ->
|
|
|
|
Dynamic[{
|
|
|
|
Automatic, 1.35 CurrentValue["FontCapHeight"]/
|
|
|
|
AbsoluteCurrentValue[Magnification]}]],
|
|
|
|
StyleBox[
|
|
|
|
RowBox[{"GrayLevel", "[", "0", "]"}], NumberMarks ->
|
|
|
|
False]], Appearance -> None, BaseStyle -> {},
|
|
|
|
BaselinePosition -> Baseline, DefaultBaseStyle -> {},
|
|
|
|
ButtonFunction :> With[{Typeset`box$ = EvaluationBox[]},
|
|
|
|
If[
|
|
|
|
Not[
|
|
|
|
AbsoluteCurrentValue["Deployed"]],
|
|
|
|
SelectionMove[Typeset`box$, All, Expression];
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialAlpha = 1;
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialColor =
|
|
|
|
GrayLevel[0];
|
|
|
|
FrontEnd`Private`$ColorSelectorUseMakeBoxes = True;
|
|
|
|
MathLink`CallFrontEnd[
|
|
|
|
FrontEnd`AttachCell[Typeset`box$,
|
|
|
|
FrontEndResource["GrayLevelColorValueSelector"], {
|
|
|
|
0, {Left, Bottom}}, {Left, Top},
|
|
|
|
"ClosingActions" -> {
|
|
|
|
"SelectionDeparture", "ParentChanged",
|
|
|
|
"EvaluatorQuit"}]]]], BaseStyle -> Inherited, Evaluator ->
|
|
|
|
Automatic, Method -> "Preemptive"],
|
|
|
|
GrayLevel[0], Editable -> False, Selectable -> False]}],
|
|
|
|
"]"}], ",",
|
|
|
|
RowBox[{"Directive", "[",
|
|
|
|
RowBox[{
|
|
|
|
RowBox[{"PointSize", "[", "0.009166666666666668`", "]"}],
|
|
|
|
",",
|
|
|
|
RowBox[{"CapForm", "[", "\"Butt\"", "]"}], ",",
|
|
|
|
RowBox[{"AbsoluteThickness", "[", "1.6`", "]"}], ",",
|
|
|
|
RowBox[{"Thickness", "[", "0.01`", "]"}], ",",
|
|
|
|
InterpretationBox[
|
|
|
|
ButtonBox[
|
|
|
|
TooltipBox[
|
|
|
|
GraphicsBox[{{
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{0, 0}]}, {
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{1, -1}]}, {
|
|
|
|
GrayLevel[0.5],
|
|
|
|
RectangleBox[{0, -1}, {2, 1}]}}, DefaultBaseStyle ->
|
|
|
|
"ColorSwatchGraphics", AspectRatio -> 1, Frame -> True,
|
|
|
|
FrameStyle -> GrayLevel[0.33333333333333337`], FrameTicks ->
|
|
|
|
None, PlotRangePadding -> None, ImageSize ->
|
|
|
|
Dynamic[{
|
|
|
|
Automatic, 1.35 CurrentValue["FontCapHeight"]/
|
|
|
|
AbsoluteCurrentValue[Magnification]}]],
|
|
|
|
StyleBox[
|
|
|
|
RowBox[{"GrayLevel", "[", "0.5`", "]"}], NumberMarks ->
|
|
|
|
False]], Appearance -> None, BaseStyle -> {},
|
|
|
|
BaselinePosition -> Baseline, DefaultBaseStyle -> {},
|
|
|
|
ButtonFunction :> With[{Typeset`box$ = EvaluationBox[]},
|
|
|
|
If[
|
|
|
|
Not[
|
|
|
|
AbsoluteCurrentValue["Deployed"]],
|
|
|
|
SelectionMove[Typeset`box$, All, Expression];
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialAlpha = 1;
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialColor =
|
|
|
|
GrayLevel[0.5];
|
|
|
|
FrontEnd`Private`$ColorSelectorUseMakeBoxes = True;
|
|
|
|
MathLink`CallFrontEnd[
|
|
|
|
FrontEnd`AttachCell[Typeset`box$,
|
|
|
|
FrontEndResource["GrayLevelColorValueSelector"], {
|
|
|
|
0, {Left, Bottom}}, {Left, Top},
|
|
|
|
"ClosingActions" -> {
|
|
|
|
"SelectionDeparture", "ParentChanged",
|
|
|
|
"EvaluatorQuit"}]]]], BaseStyle -> Inherited, Evaluator ->
|
|
|
|
Automatic, Method -> "Preemptive"],
|
|
|
|
GrayLevel[0.5], Editable -> False, Selectable -> False]}],
|
|
|
|
"]"}]}], "}"}], ",",
|
|
|
|
RowBox[{"{",
|
|
|
|
RowBox[{#, ",", #2, ",", #3, ",", #4, ",", #5}], "}"}], ",",
|
|
|
|
RowBox[{"LegendMarkers", "\[Rule]",
|
|
|
|
RowBox[{"{",
|
|
|
|
RowBox[{
|
|
|
|
RowBox[{"{",
|
|
|
|
RowBox[{"False", ",", "Automatic"}], "}"}], ",",
|
|
|
|
RowBox[{"{",
|
|
|
|
RowBox[{"False", ",", "Automatic"}], "}"}], ",",
|
|
|
|
RowBox[{"{",
|
|
|
|
RowBox[{"False", ",", "Automatic"}], "}"}], ",",
|
|
|
|
RowBox[{"{",
|
|
|
|
RowBox[{"False", ",", "Automatic"}], "}"}], ",",
|
|
|
|
RowBox[{"{",
|
|
|
|
RowBox[{"False", ",", "Automatic"}], "}"}]}], "}"}]}], ",",
|
|
|
|
RowBox[{"Joined", "\[Rule]",
|
|
|
|
RowBox[{"{",
|
|
|
|
|
|
|
|
RowBox[{
|
|
|
|
"True", ",", "True", ",", "True", ",", "True", ",", "True"}],
|
|
|
|
"}"}]}], ",",
|
|
|
|
RowBox[{"LabelStyle", "\[Rule]",
|
|
|
|
RowBox[{"{",
|
|
|
|
RowBox[{"FontFamily", "\[Rule]", "\"Times\""}], "}"}]}], ",",
|
|
|
|
RowBox[{"LegendLayout", "\[Rule]", "\"Column\""}]}], "]"}]& )],
|
|
|
|
Scaled[{0.99, 0.99}], ImageScaled[{1, 1}],
|
|
|
|
BaseStyle->{FontSize -> Larger},
|
|
|
|
FormatType->StandardForm]},
|
|
|
|
AspectRatio->1,
|
|
|
|
Axes->{False, False},
|
|
|
|
AxesLabel->{None, None},
|
|
|
|
AxesOrigin->{1.1, -199.},
|
|
|
|
BaseStyle->18,
|
|
|
|
DisplayFunction->Identity,
|
|
|
|
Frame->{{True, True}, {True, True}},
|
|
|
|
FrameLabel->{{
|
|
|
|
FormBox[
|
|
|
|
StyleBox[
|
|
|
|
"\"\\!\\(\\*StyleBox[\\\"E\\\",FontSlant->\\\"Italic\\\"]\\)(F-F) \
|
|
|
|
(hartree)\"", FontSize -> 20, StripOnInput -> False], TraditionalForm],
|
|
|
|
None}, {
|
|
|
|
FormBox[
|
|
|
|
StyleBox[
|
|
|
|
"\"\\!\\(\\*SubscriptBox[\\(R\\), \\(F - F\\)]\\) (\[Angstrom])\"",
|
|
|
|
FontSize -> 20, StripOnInput -> False], TraditionalForm], None}},
|
|
|
|
FrameStyle->Automatic,
|
|
|
|
FrameTicks->{{Automatic, Automatic}, {Automatic, Automatic}},
|
|
|
|
GridLines->{Automatic, Automatic},
|
|
|
|
GridLinesStyle->Directive[
|
|
|
|
GrayLevel[0.5, 0.4]],
|
|
|
|
ImageSize->500,
|
|
|
|
LabelStyle->{FontFamily -> "Times"},
|
|
|
|
Method->{
|
|
|
|
"OptimizePlotMarkers" -> True, "OptimizePlotMarkers" -> True,
|
|
|
|
"CoordinatesToolOptions" -> {"DisplayFunction" -> ({
|
|
|
|
Identity[
|
|
|
|
Part[#, 1]],
|
|
|
|
Identity[
|
|
|
|
Part[#, 2]]}& ), "CopiedValueFunction" -> ({
|
|
|
|
Identity[
|
|
|
|
Part[#, 1]],
|
|
|
|
Identity[
|
|
|
|
Part[#, 2]]}& )}},
|
2022-04-25 14:17:16 +02:00
|
|
|
PlotRange->{{1.1, 1.65}, {-199.125, -199}},
|
2022-04-22 11:43:01 +02:00
|
|
|
PlotRangeClipping->True,
|
|
|
|
PlotRangePadding->{{0, 0}, {0, 0}},
|
|
|
|
Ticks->{Automatic, Automatic}],
|
|
|
|
InterpretTemplate[Legended[
|
|
|
|
Graphics[{{}, {{{}, {}, {
|
|
|
|
Hue[0.67, 0.6, 0.6],
|
|
|
|
Directive[
|
|
|
|
PointSize[0.009166666666666668],
|
|
|
|
CapForm["Butt"],
|
|
|
|
AbsoluteThickness[1.6],
|
|
|
|
Thickness[0.01],
|
|
|
|
RGBColor[1, 0.5, 0]],
|
2022-04-25 14:17:16 +02:00
|
|
|
Line[{{1.1186000920834196`, -199.}, {1.16419, -199.0388640823}, {
|
|
|
|
1.21711, -199.0692686079}, {1.27002, -199.0889640392}, {
|
|
|
|
1.32294, -199.1009044038}, {1.37586, -199.1072986871}, {
|
|
|
|
1.42878, -199.1097975546}, {1.4817, -199.1096214147}, {
|
|
|
|
1.53461, -199.1076633248}, {1.58753, -199.1045747396}, {
|
|
|
|
1.64045, -199.1008324508}, {1.69337, -199.0967858098}, {
|
|
|
|
1.74628, -199.0926887251}}]}, {
|
2022-04-22 11:43:01 +02:00
|
|
|
Hue[0.9060679774997897, 0.6, 0.6],
|
|
|
|
Directive[
|
|
|
|
PointSize[0.009166666666666668],
|
|
|
|
CapForm["Butt"],
|
|
|
|
AbsoluteThickness[1.6],
|
|
|
|
Thickness[0.01],
|
|
|
|
RGBColor[1, 0, 0]],
|
2022-04-25 14:17:16 +02:00
|
|
|
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Zt5X+01JiaJdj2HmfbPncVdOnfwYZt43ex0WkfOL4OZ9s783KU9mA9y87/bb
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JiTzbYKb991ePYWVdx3cvB/27NVREsvg5v2wX6agGjkZbt4P+/lT9n9rhJv3
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03428+OUbLh5P+1PFTvsCYWb98v+rvpzVzu4eb/sV16/ul0eyAcAl5ux3w==
|
|
|
|
|
2022-04-22 11:43:01 +02:00
|
|
|
"]]},
|
|
|
|
{GrayLevel[0], PointSize[0.009166666666666668], Thickness[0.01],
|
|
|
|
CapForm["Butt"], LineBox[CompressedData["
|
2022-04-25 14:17:16 +02:00
|
|
|
1:eJxTTMoPSmViYGCQBGIQPYur2ZXn/0d7BhB4kHEATDN8shfl/fSaEchPA4NP
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9vkOr/avA/LPngGBT/aLq+em2T3MOGAMBp/tZ/upP94C5M+aCQKf7avUuJaK
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|
|
PoKZ98Xe10dhffIjmHlf7Dtf1U9a+Ahm3hd79S3r+i4+gpn31f6WV/fMr49g
|
|
|
|
5n21v2D2N4P/Mcy8b/aHV5+uUngMM++bfdR9e2mtxzDzvtnvi/mdpfsYZt53
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|
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+6syQSnaj2HmfbfP3Oj1QAVu3g97Oy2L2VJw837Yy4V/tuCFm/fDfpbmdI+/
|
|
|
|
cPf9tJ+lvN/9Ndx9P+2dQ32WXof795d9pNfGw4fg/v1l/8vqxq81cP/+st+8
|
|
|
|
+uDMaXDzfts/+/nteT2QDwBngMrU
|
2022-04-22 11:43:01 +02:00
|
|
|
"]]},
|
|
|
|
{GrayLevel[0.5], PointSize[0.009166666666666668], Thickness[0.01],
|
|
|
|
CapForm["Butt"], LineBox[CompressedData["
|
2022-04-25 14:17:16 +02:00
|
|
|
1:eJxTTMoPSmViYGCQBGIQPXWtqv38fx/tGUDgQcYBMM3wyd54o8wJJiA/DQw+
|
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2f848mXJeiD/7BkQ+GTft/9jiP3DjAPGYPDZfvrlj7e2AvmzZoLAZ/vMsyHL
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xB7BzPtiX3v64c6URzDzvtjPLV+6bNEjmHlf7O9GKq259Ahm3lf7ecfMD3x7
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BDPvq71A3PkZAo9h5n2zd9m5cbPiY5h53+wLW9RjtR/DzPtmn8ByfqveY5h5
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3+03HPi6XecxzLzv9vn5M23U4Ob9sH8kx8QgAzfvh/0Bvj9L+eDm/bB/Xj9l
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7z+4+37af1SKOPIG7r6f9ueVJTRvwv37y95hpanfEbh/f9lnSXR2r4P795d9
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|
|
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8yEOgxlw837br/4d19wI5AMAKYrM7g==
|
2022-04-22 11:43:01 +02:00
|
|
|
"]]}}, {{}, {}}}, InsetBox[
|
|
|
|
TemplateBox[{
|
|
|
|
StyleBox["\"CC3\"", FontSize -> 20, StripOnInput -> False],
|
|
|
|
StyleBox["\"CCSD\"", FontSize -> 20, StripOnInput -> False],
|
|
|
|
StyleBox[
|
|
|
|
"\"BSE@\\!\\(\\*SubscriptBox[\\(G\\), \
|
2022-04-25 14:17:16 +02:00
|
|
|
\\(0\\)]\\)\\!\\(\\*SubscriptBox[\\(W\\), \\(0\\)]\\)@HF (\[Kappa] = 0 au)\"",
|
|
|
|
FontSize -> 20, StripOnInput -> False],
|
2022-04-22 11:43:01 +02:00
|
|
|
StyleBox[
|
|
|
|
"\"BSE@\\!\\(\\*SubscriptBox[\\(G\\), \
|
2022-04-25 14:17:16 +02:00
|
|
|
\\(0\\)]\\)\\!\\(\\*SubscriptBox[\\(W\\), \\(0\\)]\\)@HF (\[Kappa] = 10 \
|
|
|
|
au)\"", FontSize -> 20, StripOnInput -> False],
|
2022-04-22 11:43:01 +02:00
|
|
|
StyleBox[
|
2022-04-25 14:17:16 +02:00
|
|
|
"\"BSE@evGW@HF (\[Kappa] = 10 au)\"", FontSize -> 20, StripOnInput ->
|
2022-04-22 11:43:01 +02:00
|
|
|
False]},
|
|
|
|
"PointLegend",
|
|
|
|
DisplayFunction->(FormBox[
|
|
|
|
StyleBox[
|
|
|
|
StyleBox[
|
|
|
|
PaneBox[
|
|
|
|
TagBox[
|
|
|
|
GridBox[{{
|
|
|
|
TagBox[
|
|
|
|
GridBox[{{
|
|
|
|
GraphicsBox[{{
|
|
|
|
Directive[
|
|
|
|
EdgeForm[
|
|
|
|
Directive[
|
|
|
|
Opacity[0.3],
|
|
|
|
GrayLevel[0]]],
|
|
|
|
PointSize[0.5],
|
|
|
|
CapForm["Butt"],
|
|
|
|
AbsoluteThickness[1.6],
|
|
|
|
Thickness[0.18],
|
|
|
|
RGBColor[1, 0.5, 0]], {
|
|
|
|
LineBox[{{0, 10}, {20, 10}}]}}, {
|
|
|
|
Directive[
|
|
|
|
EdgeForm[
|
|
|
|
Directive[
|
|
|
|
Opacity[0.3],
|
|
|
|
GrayLevel[0]]],
|
|
|
|
PointSize[0.5],
|
|
|
|
CapForm["Butt"],
|
|
|
|
AbsoluteThickness[1.6],
|
|
|
|
Thickness[0.18],
|
|
|
|
RGBColor[1, 0.5, 0]], {}}}, AspectRatio -> Full,
|
|
|
|
ImageSize -> {20, 10}, PlotRangePadding -> None,
|
|
|
|
ImagePadding -> Automatic,
|
|
|
|
BaselinePosition -> (Scaled[0.1] -> Baseline)], #}, {
|
|
|
|
GraphicsBox[{{
|
|
|
|
Directive[
|
|
|
|
EdgeForm[
|
|
|
|
Directive[
|
|
|
|
Opacity[0.3],
|
|
|
|
GrayLevel[0]]],
|
|
|
|
PointSize[0.5],
|
|
|
|
CapForm["Butt"],
|
|
|
|
AbsoluteThickness[1.6],
|
|
|
|
Thickness[0.18],
|
|
|
|
RGBColor[1, 0, 0]], {
|
|
|
|
LineBox[{{0, 10}, {20, 10}}]}}, {
|
|
|
|
Directive[
|
|
|
|
EdgeForm[
|
|
|
|
Directive[
|
|
|
|
Opacity[0.3],
|
|
|
|
GrayLevel[0]]],
|
|
|
|
PointSize[0.5],
|
|
|
|
CapForm["Butt"],
|
|
|
|
AbsoluteThickness[1.6],
|
|
|
|
Thickness[0.18],
|
|
|
|
RGBColor[1, 0, 0]], {}}}, AspectRatio -> Full,
|
|
|
|
ImageSize -> {20, 10}, PlotRangePadding -> None,
|
|
|
|
ImagePadding -> Automatic,
|
|
|
|
BaselinePosition -> (Scaled[0.1] -> Baseline)], #2}, {
|
|
|
|
GraphicsBox[{{
|
|
|
|
Directive[
|
|
|
|
EdgeForm[
|
|
|
|
Directive[
|
|
|
|
Opacity[0.3],
|
|
|
|
GrayLevel[0]]],
|
|
|
|
PointSize[0.5],
|
|
|
|
CapForm["Butt"],
|
|
|
|
AbsoluteThickness[1.6],
|
|
|
|
Thickness[0.18],
|
|
|
|
RGBColor[0, 0, 1]], {
|
|
|
|
LineBox[{{0, 10}, {20, 10}}]}}, {
|
|
|
|
Directive[
|
|
|
|
EdgeForm[
|
|
|
|
Directive[
|
|
|
|
Opacity[0.3],
|
|
|
|
GrayLevel[0]]],
|
|
|
|
PointSize[0.5],
|
|
|
|
CapForm["Butt"],
|
|
|
|
AbsoluteThickness[1.6],
|
|
|
|
Thickness[0.18],
|
|
|
|
RGBColor[0, 0, 1]], {}}}, AspectRatio -> Full,
|
|
|
|
ImageSize -> {20, 10}, PlotRangePadding -> None,
|
|
|
|
ImagePadding -> Automatic,
|
|
|
|
BaselinePosition -> (Scaled[0.1] -> Baseline)], #3}, {
|
|
|
|
GraphicsBox[{{
|
|
|
|
Directive[
|
|
|
|
EdgeForm[
|
|
|
|
Directive[
|
|
|
|
Opacity[0.3],
|
|
|
|
GrayLevel[0]]],
|
|
|
|
PointSize[0.5],
|
|
|
|
CapForm["Butt"],
|
|
|
|
AbsoluteThickness[1.6],
|
|
|
|
Thickness[0.18],
|
|
|
|
GrayLevel[0]], {
|
|
|
|
LineBox[{{0, 10}, {20, 10}}]}}, {
|
|
|
|
Directive[
|
|
|
|
EdgeForm[
|
|
|
|
Directive[
|
|
|
|
Opacity[0.3],
|
|
|
|
GrayLevel[0]]],
|
|
|
|
PointSize[0.5],
|
|
|
|
CapForm["Butt"],
|
|
|
|
AbsoluteThickness[1.6],
|
|
|
|
Thickness[0.18],
|
|
|
|
GrayLevel[0]], {}}}, AspectRatio -> Full,
|
|
|
|
ImageSize -> {20, 10}, PlotRangePadding -> None,
|
|
|
|
ImagePadding -> Automatic,
|
|
|
|
BaselinePosition -> (Scaled[0.1] -> Baseline)], #4}, {
|
|
|
|
GraphicsBox[{{
|
|
|
|
Directive[
|
|
|
|
EdgeForm[
|
|
|
|
Directive[
|
|
|
|
Opacity[0.3],
|
|
|
|
GrayLevel[0]]],
|
|
|
|
PointSize[0.5],
|
|
|
|
CapForm["Butt"],
|
|
|
|
AbsoluteThickness[1.6],
|
|
|
|
Thickness[0.18],
|
|
|
|
GrayLevel[0.5]], {
|
|
|
|
LineBox[{{0, 10}, {20, 10}}]}}, {
|
|
|
|
Directive[
|
|
|
|
EdgeForm[
|
|
|
|
Directive[
|
|
|
|
Opacity[0.3],
|
|
|
|
GrayLevel[0]]],
|
|
|
|
PointSize[0.5],
|
|
|
|
CapForm["Butt"],
|
|
|
|
AbsoluteThickness[1.6],
|
|
|
|
Thickness[0.18],
|
|
|
|
GrayLevel[0.5]], {}}}, AspectRatio -> Full,
|
|
|
|
ImageSize -> {20, 10}, PlotRangePadding -> None,
|
|
|
|
ImagePadding -> Automatic,
|
|
|
|
BaselinePosition -> (Scaled[0.1] -> Baseline)], #5}},
|
|
|
|
GridBoxAlignment -> {
|
|
|
|
"Columns" -> {Center, Left}, "Rows" -> {{Baseline}}},
|
|
|
|
AutoDelete -> False,
|
|
|
|
GridBoxDividers -> {
|
|
|
|
"Columns" -> {{False}}, "Rows" -> {{False}}},
|
|
|
|
GridBoxItemSize -> {"Columns" -> {{All}}, "Rows" -> {{All}}},
|
|
|
|
GridBoxSpacings -> {
|
|
|
|
"Columns" -> {{0.5}}, "Rows" -> {{0.8}}}], "Grid"]}},
|
|
|
|
GridBoxAlignment -> {"Columns" -> {{Left}}, "Rows" -> {{Top}}},
|
|
|
|
AutoDelete -> False,
|
|
|
|
GridBoxItemSize -> {
|
|
|
|
"Columns" -> {{Automatic}}, "Rows" -> {{Automatic}}},
|
|
|
|
GridBoxSpacings -> {"Columns" -> {{1}}, "Rows" -> {{0}}}],
|
|
|
|
"Grid"], Alignment -> Left, AppearanceElements -> None,
|
|
|
|
ImageMargins -> {{5, 5}, {5, 5}}, ImageSizeAction ->
|
|
|
|
"ResizeToFit"], LineIndent -> 0, StripOnInput -> False], {
|
|
|
|
FontFamily -> "Times"}, Background -> Automatic, StripOnInput ->
|
|
|
|
False], TraditionalForm]& ),
|
|
|
|
Editable->True,
|
|
|
|
InterpretationFunction:>(RowBox[{"PointLegend", "[",
|
|
|
|
RowBox[{
|
|
|
|
RowBox[{"{",
|
|
|
|
RowBox[{
|
|
|
|
RowBox[{"Directive", "[",
|
|
|
|
RowBox[{
|
|
|
|
RowBox[{"PointSize", "[", "0.009166666666666668`", "]"}],
|
|
|
|
",",
|
|
|
|
RowBox[{"CapForm", "[", "\"Butt\"", "]"}], ",",
|
|
|
|
RowBox[{"AbsoluteThickness", "[", "1.6`", "]"}], ",",
|
|
|
|
RowBox[{"Thickness", "[", "0.01`", "]"}], ",",
|
|
|
|
InterpretationBox[
|
|
|
|
ButtonBox[
|
|
|
|
TooltipBox[
|
|
|
|
GraphicsBox[{{
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{0, 0}]}, {
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{1, -1}]}, {
|
|
|
|
RGBColor[1, 0.5, 0],
|
|
|
|
RectangleBox[{0, -1}, {2, 1}]}}, DefaultBaseStyle ->
|
|
|
|
"ColorSwatchGraphics", AspectRatio -> 1, Frame -> True,
|
|
|
|
FrameStyle ->
|
|
|
|
RGBColor[0.6666666666666666, 0.33333333333333337`, 0.],
|
|
|
|
FrameTicks -> None, PlotRangePadding -> None, ImageSize ->
|
|
|
|
Dynamic[{
|
|
|
|
Automatic, 1.35 CurrentValue["FontCapHeight"]/
|
|
|
|
AbsoluteCurrentValue[Magnification]}]],
|
|
|
|
StyleBox[
|
|
|
|
RowBox[{"RGBColor", "[",
|
|
|
|
RowBox[{"1", ",", "0.5`", ",", "0"}], "]"}], NumberMarks ->
|
|
|
|
False]], Appearance -> None, BaseStyle -> {},
|
|
|
|
BaselinePosition -> Baseline, DefaultBaseStyle -> {},
|
|
|
|
ButtonFunction :> With[{Typeset`box$ = EvaluationBox[]},
|
|
|
|
If[
|
|
|
|
Not[
|
|
|
|
AbsoluteCurrentValue["Deployed"]],
|
|
|
|
SelectionMove[Typeset`box$, All, Expression];
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialAlpha = 1;
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialColor =
|
|
|
|
RGBColor[1, 0.5, 0];
|
|
|
|
FrontEnd`Private`$ColorSelectorUseMakeBoxes = True;
|
|
|
|
MathLink`CallFrontEnd[
|
|
|
|
FrontEnd`AttachCell[Typeset`box$,
|
|
|
|
FrontEndResource["RGBColorValueSelector"], {
|
|
|
|
0, {Left, Bottom}}, {Left, Top},
|
|
|
|
"ClosingActions" -> {
|
|
|
|
"SelectionDeparture", "ParentChanged",
|
|
|
|
"EvaluatorQuit"}]]]], BaseStyle -> Inherited, Evaluator ->
|
|
|
|
Automatic, Method -> "Preemptive"],
|
|
|
|
RGBColor[1, 0.5, 0], Editable -> False, Selectable ->
|
|
|
|
False]}], "]"}], ",",
|
|
|
|
RowBox[{"Directive", "[",
|
|
|
|
RowBox[{
|
|
|
|
RowBox[{"PointSize", "[", "0.009166666666666668`", "]"}],
|
|
|
|
",",
|
|
|
|
RowBox[{"CapForm", "[", "\"Butt\"", "]"}], ",",
|
|
|
|
RowBox[{"AbsoluteThickness", "[", "1.6`", "]"}], ",",
|
|
|
|
RowBox[{"Thickness", "[", "0.01`", "]"}], ",",
|
|
|
|
InterpretationBox[
|
|
|
|
ButtonBox[
|
|
|
|
TooltipBox[
|
|
|
|
GraphicsBox[{{
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{0, 0}]}, {
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{1, -1}]}, {
|
|
|
|
RGBColor[1, 0, 0],
|
|
|
|
RectangleBox[{0, -1}, {2, 1}]}}, DefaultBaseStyle ->
|
|
|
|
"ColorSwatchGraphics", AspectRatio -> 1, Frame -> True,
|
|
|
|
FrameStyle -> RGBColor[0.6666666666666666, 0., 0.],
|
|
|
|
FrameTicks -> None, PlotRangePadding -> None, ImageSize ->
|
|
|
|
Dynamic[{
|
|
|
|
Automatic, 1.35 CurrentValue["FontCapHeight"]/
|
|
|
|
AbsoluteCurrentValue[Magnification]}]],
|
|
|
|
StyleBox[
|
|
|
|
RowBox[{"RGBColor", "[",
|
|
|
|
RowBox[{"1", ",", "0", ",", "0"}], "]"}], NumberMarks ->
|
|
|
|
False]], Appearance -> None, BaseStyle -> {},
|
|
|
|
BaselinePosition -> Baseline, DefaultBaseStyle -> {},
|
|
|
|
ButtonFunction :> With[{Typeset`box$ = EvaluationBox[]},
|
|
|
|
If[
|
|
|
|
Not[
|
|
|
|
AbsoluteCurrentValue["Deployed"]],
|
|
|
|
SelectionMove[Typeset`box$, All, Expression];
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialAlpha = 1;
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialColor =
|
|
|
|
RGBColor[1, 0, 0];
|
|
|
|
FrontEnd`Private`$ColorSelectorUseMakeBoxes = True;
|
|
|
|
MathLink`CallFrontEnd[
|
|
|
|
FrontEnd`AttachCell[Typeset`box$,
|
|
|
|
FrontEndResource["RGBColorValueSelector"], {
|
|
|
|
0, {Left, Bottom}}, {Left, Top},
|
|
|
|
"ClosingActions" -> {
|
|
|
|
"SelectionDeparture", "ParentChanged",
|
|
|
|
"EvaluatorQuit"}]]]], BaseStyle -> Inherited, Evaluator ->
|
|
|
|
Automatic, Method -> "Preemptive"],
|
|
|
|
RGBColor[1, 0, 0], Editable -> False, Selectable ->
|
|
|
|
False]}], "]"}], ",",
|
|
|
|
RowBox[{"Directive", "[",
|
|
|
|
RowBox[{
|
|
|
|
RowBox[{"PointSize", "[", "0.009166666666666668`", "]"}],
|
|
|
|
",",
|
|
|
|
RowBox[{"CapForm", "[", "\"Butt\"", "]"}], ",",
|
|
|
|
RowBox[{"AbsoluteThickness", "[", "1.6`", "]"}], ",",
|
|
|
|
RowBox[{"Thickness", "[", "0.01`", "]"}], ",",
|
|
|
|
InterpretationBox[
|
|
|
|
ButtonBox[
|
|
|
|
TooltipBox[
|
|
|
|
GraphicsBox[{{
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{0, 0}]}, {
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{1, -1}]}, {
|
|
|
|
RGBColor[0, 0, 1],
|
|
|
|
RectangleBox[{0, -1}, {2, 1}]}}, DefaultBaseStyle ->
|
|
|
|
"ColorSwatchGraphics", AspectRatio -> 1, Frame -> True,
|
|
|
|
FrameStyle -> RGBColor[0., 0., 0.6666666666666666],
|
|
|
|
FrameTicks -> None, PlotRangePadding -> None, ImageSize ->
|
|
|
|
Dynamic[{
|
|
|
|
Automatic, 1.35 CurrentValue["FontCapHeight"]/
|
|
|
|
AbsoluteCurrentValue[Magnification]}]],
|
|
|
|
StyleBox[
|
|
|
|
RowBox[{"RGBColor", "[",
|
|
|
|
RowBox[{"0", ",", "0", ",", "1"}], "]"}], NumberMarks ->
|
|
|
|
False]], Appearance -> None, BaseStyle -> {},
|
|
|
|
BaselinePosition -> Baseline, DefaultBaseStyle -> {},
|
|
|
|
ButtonFunction :> With[{Typeset`box$ = EvaluationBox[]},
|
|
|
|
If[
|
|
|
|
Not[
|
|
|
|
AbsoluteCurrentValue["Deployed"]],
|
|
|
|
SelectionMove[Typeset`box$, All, Expression];
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialAlpha = 1;
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialColor =
|
|
|
|
RGBColor[0, 0, 1];
|
|
|
|
FrontEnd`Private`$ColorSelectorUseMakeBoxes = True;
|
|
|
|
MathLink`CallFrontEnd[
|
|
|
|
FrontEnd`AttachCell[Typeset`box$,
|
|
|
|
FrontEndResource["RGBColorValueSelector"], {
|
|
|
|
0, {Left, Bottom}}, {Left, Top},
|
|
|
|
"ClosingActions" -> {
|
|
|
|
"SelectionDeparture", "ParentChanged",
|
|
|
|
"EvaluatorQuit"}]]]], BaseStyle -> Inherited, Evaluator ->
|
|
|
|
Automatic, Method -> "Preemptive"],
|
|
|
|
RGBColor[0, 0, 1], Editable -> False, Selectable ->
|
|
|
|
False]}], "]"}], ",",
|
|
|
|
RowBox[{"Directive", "[",
|
|
|
|
RowBox[{
|
|
|
|
RowBox[{"PointSize", "[", "0.009166666666666668`", "]"}],
|
|
|
|
",",
|
|
|
|
RowBox[{"CapForm", "[", "\"Butt\"", "]"}], ",",
|
|
|
|
RowBox[{"AbsoluteThickness", "[", "1.6`", "]"}], ",",
|
|
|
|
RowBox[{"Thickness", "[", "0.01`", "]"}], ",",
|
|
|
|
InterpretationBox[
|
|
|
|
ButtonBox[
|
|
|
|
TooltipBox[
|
|
|
|
GraphicsBox[{{
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{0, 0}]}, {
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{1, -1}]}, {
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{0, -1}, {2, 1}]}}, DefaultBaseStyle ->
|
|
|
|
"ColorSwatchGraphics", AspectRatio -> 1, Frame -> True,
|
|
|
|
FrameStyle -> GrayLevel[0.], FrameTicks -> None,
|
|
|
|
PlotRangePadding -> None, ImageSize ->
|
|
|
|
Dynamic[{
|
|
|
|
Automatic, 1.35 CurrentValue["FontCapHeight"]/
|
|
|
|
AbsoluteCurrentValue[Magnification]}]],
|
|
|
|
StyleBox[
|
|
|
|
RowBox[{"GrayLevel", "[", "0", "]"}], NumberMarks ->
|
|
|
|
False]], Appearance -> None, BaseStyle -> {},
|
|
|
|
BaselinePosition -> Baseline, DefaultBaseStyle -> {},
|
|
|
|
ButtonFunction :> With[{Typeset`box$ = EvaluationBox[]},
|
|
|
|
If[
|
|
|
|
Not[
|
|
|
|
AbsoluteCurrentValue["Deployed"]],
|
|
|
|
SelectionMove[Typeset`box$, All, Expression];
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialAlpha = 1;
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialColor =
|
|
|
|
GrayLevel[0];
|
|
|
|
FrontEnd`Private`$ColorSelectorUseMakeBoxes = True;
|
|
|
|
MathLink`CallFrontEnd[
|
|
|
|
FrontEnd`AttachCell[Typeset`box$,
|
|
|
|
FrontEndResource["GrayLevelColorValueSelector"], {
|
|
|
|
0, {Left, Bottom}}, {Left, Top},
|
|
|
|
"ClosingActions" -> {
|
|
|
|
"SelectionDeparture", "ParentChanged",
|
|
|
|
"EvaluatorQuit"}]]]], BaseStyle -> Inherited, Evaluator ->
|
|
|
|
Automatic, Method -> "Preemptive"],
|
|
|
|
GrayLevel[0], Editable -> False, Selectable -> False]}],
|
|
|
|
"]"}], ",",
|
|
|
|
RowBox[{"Directive", "[",
|
|
|
|
RowBox[{
|
|
|
|
RowBox[{"PointSize", "[", "0.009166666666666668`", "]"}],
|
|
|
|
",",
|
|
|
|
RowBox[{"CapForm", "[", "\"Butt\"", "]"}], ",",
|
|
|
|
RowBox[{"AbsoluteThickness", "[", "1.6`", "]"}], ",",
|
|
|
|
RowBox[{"Thickness", "[", "0.01`", "]"}], ",",
|
|
|
|
InterpretationBox[
|
|
|
|
ButtonBox[
|
|
|
|
TooltipBox[
|
|
|
|
GraphicsBox[{{
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{0, 0}]}, {
|
|
|
|
GrayLevel[0],
|
|
|
|
RectangleBox[{1, -1}]}, {
|
|
|
|
GrayLevel[0.5],
|
|
|
|
RectangleBox[{0, -1}, {2, 1}]}}, DefaultBaseStyle ->
|
|
|
|
"ColorSwatchGraphics", AspectRatio -> 1, Frame -> True,
|
|
|
|
FrameStyle -> GrayLevel[0.33333333333333337`], FrameTicks ->
|
|
|
|
None, PlotRangePadding -> None, ImageSize ->
|
|
|
|
Dynamic[{
|
|
|
|
Automatic, 1.35 CurrentValue["FontCapHeight"]/
|
|
|
|
AbsoluteCurrentValue[Magnification]}]],
|
|
|
|
StyleBox[
|
|
|
|
RowBox[{"GrayLevel", "[", "0.5`", "]"}], NumberMarks ->
|
|
|
|
False]], Appearance -> None, BaseStyle -> {},
|
|
|
|
BaselinePosition -> Baseline, DefaultBaseStyle -> {},
|
|
|
|
ButtonFunction :> With[{Typeset`box$ = EvaluationBox[]},
|
|
|
|
If[
|
|
|
|
Not[
|
|
|
|
AbsoluteCurrentValue["Deployed"]],
|
|
|
|
SelectionMove[Typeset`box$, All, Expression];
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialAlpha = 1;
|
|
|
|
FrontEnd`Private`$ColorSelectorInitialColor =
|
|
|
|
GrayLevel[0.5];
|
|
|
|
FrontEnd`Private`$ColorSelectorUseMakeBoxes = True;
|
|
|
|
MathLink`CallFrontEnd[
|
|
|
|
FrontEnd`AttachCell[Typeset`box$,
|
|
|
|
FrontEndResource["GrayLevelColorValueSelector"], {
|
|
|
|
0, {Left, Bottom}}, {Left, Top},
|
|
|
|
"ClosingActions" -> {
|
|
|
|
"SelectionDeparture", "ParentChanged",
|
|
|
|
"EvaluatorQuit"}]]]], BaseStyle -> Inherited, Evaluator ->
|
|
|
|
Automatic, Method -> "Preemptive"],
|
|
|
|
GrayLevel[0.5], Editable -> False, Selectable -> False]}],
|
|
|
|
"]"}]}], "}"}], ",",
|
|
|
|
RowBox[{"{",
|
|
|
|
RowBox[{#, ",", #2, ",", #3, ",", #4, ",", #5}], "}"}], ",",
|
|
|
|
RowBox[{"LegendMarkers", "\[Rule]",
|
|
|
|
RowBox[{"{",
|
|
|
|
RowBox[{
|
|
|
|
RowBox[{"{",
|
|
|
|
RowBox[{"False", ",", "Automatic"}], "}"}], ",",
|
|
|
|
RowBox[{"{",
|
|
|
|
RowBox[{"False", ",", "Automatic"}], "}"}], ",",
|
|
|
|
RowBox[{"{",
|
|
|
|
RowBox[{"False", ",", "Automatic"}], "}"}], ",",
|
|
|
|
RowBox[{"{",
|
|
|
|
RowBox[{"False", ",", "Automatic"}], "}"}], ",",
|
|
|
|
RowBox[{"{",
|
|
|
|
RowBox[{"False", ",", "Automatic"}], "}"}]}], "}"}]}], ",",
|
|
|
|
RowBox[{"Joined", "\[Rule]",
|
|
|
|
RowBox[{"{",
|
|
|
|
|
|
|
|
RowBox[{
|
|
|
|
"True", ",", "True", ",", "True", ",", "True", ",", "True"}],
|
|
|
|
"}"}]}], ",",
|
|
|
|
RowBox[{"LabelStyle", "\[Rule]",
|
|
|
|
RowBox[{"{",
|
|
|
|
RowBox[{"FontFamily", "\[Rule]", "\"Times\""}], "}"}]}], ",",
|
|
|
|
RowBox[{"LegendLayout", "\[Rule]", "\"Column\""}]}], "]"}]& )],
|
|
|
|
Scaled[{0.99, 0.99}], ImageScaled[{1, 1}],
|
|
|
|
BaseStyle->{FontSize -> Larger},
|
|
|
|
FormatType->StandardForm]},
|
|
|
|
AspectRatio->1,
|
|
|
|
Axes->{False, False},
|
|
|
|
AxesLabel->{None, None},
|
|
|
|
AxesOrigin->{1.1, -199.},
|
|
|
|
BaseStyle->18,
|
|
|
|
DisplayFunction->Identity,
|
|
|
|
Frame->{{True, True}, {True, True}},
|
|
|
|
FrameLabel->{{
|
|
|
|
FormBox[
|
|
|
|
StyleBox[
|
|
|
|
"\"\\!\\(\\*StyleBox[\\\"E\\\",FontSlant->\\\"Italic\\\"]\\)(F-F) \
|
|
|
|
(hartree)\"", FontSize -> 20, StripOnInput -> False], TraditionalForm],
|
|
|
|
None}, {
|
|
|
|
FormBox[
|
|
|
|
StyleBox[
|
|
|
|
"\"\\!\\(\\*SubscriptBox[\\(R\\), \\(F - F\\)]\\) (\[Angstrom])\"",
|
|
|
|
FontSize -> 20, StripOnInput -> False], TraditionalForm], None}},
|
|
|
|
FrameStyle->Automatic,
|
|
|
|
FrameTicks->{{Automatic, Automatic}, {Automatic, Automatic}},
|
|
|
|
GridLines->{Automatic, Automatic},
|
|
|
|
GridLinesStyle->Directive[
|
|
|
|
GrayLevel[0.5, 0.4]],
|
|
|
|
ImageSize->500,
|
|
|
|
LabelStyle->{FontFamily -> "Times"},
|
|
|
|
Method->{
|
|
|
|
"OptimizePlotMarkers" -> True, "OptimizePlotMarkers" -> True,
|
|
|
|
"CoordinatesToolOptions" -> {"DisplayFunction" -> ({
|
|
|
|
Identity[
|
|
|
|
Part[#, 1]],
|
|
|
|
Identity[
|
|
|
|
Part[#, 2]]}& ), "CopiedValueFunction" -> ({
|
|
|
|
Identity[
|
|
|
|
Part[#, 1]],
|
|
|
|
Identity[
|
|
|
|
Part[#, 2]]}& )}},
|
2022-04-25 14:17:16 +02:00
|
|
|
PlotRange->{{1.1, 1.65}, {-199.125, -199}},
|
2022-04-22 11:43:01 +02:00
|
|
|
PlotRangeClipping->True,
|
|
|
|
PlotRangePadding->{{0, 0}, {0, 0}},
|
|
|
|
Ticks->{Automatic, Automatic}],
|
|
|
|
InterpretTemplate[Legended[
|
|
|
|
Graphics[{{}, {{{}, {}, {
|
|
|
|
Hue[0.67, 0.6, 0.6],
|
|
|
|
Directive[
|
|
|
|
PointSize[0.009166666666666668],
|
|
|
|
CapForm["Butt"],
|
|
|
|
AbsoluteThickness[1.6],
|
|
|
|
Thickness[0.01],
|
|
|
|
RGBColor[1, 0.5, 0]],
|
2022-04-25 14:17:16 +02:00
|
|
|
Line[{{1.1186000920834196`, -199.}, {1.16419, -199.0388640823}, {
|
|
|
|
1.21711, -199.0692686079}, {1.27002, -199.0889640392}, {
|
|
|
|
1.32294, -199.1009044038}, {1.37586, -199.1072986871}, {
|
|
|
|
1.42878, -199.1097975546}, {1.4817, -199.1096214147}, {
|
|
|
|
1.53461, -199.1076633248}, {1.58753, -199.1045747396}, {
|
|
|
|
1.64045, -199.1008324508}, {1.69337, -199.0967858098}, {
|
|
|
|
1.74628, -199.0926887251}}]}, {
|
2022-04-22 11:43:01 +02:00
|
|
|
Hue[0.9060679774997897, 0.6, 0.6],
|
|
|
|
Directive[
|
|
|
|
PointSize[0.009166666666666668],
|
|
|
|
CapForm["Butt"],
|
|
|
|
AbsoluteThickness[1.6],
|
|
|
|
Thickness[0.01],
|
|
|
|
RGBColor[1, 0, 0]],
|
2022-04-25 14:17:16 +02:00
|
|
|
Line[{{1.1246157483711674`, -199.}, {1.16419, -199.0333451097}, {
|
|
|
|
1.21711, -199.0631340935}, {1.27002, -199.082113329}, {
|
|
|
|
1.32294, -199.0932285028}, {1.37586, -199.0986805911}, {
|
|
|
|
1.42878, -199.1001132928}, {1.4817, -199.0987420273}, {
|
|
|
|
1.53461, -199.095457527}, {1.58753, -199.090912857}, {
|
|
|
|
1.64045, -199.0855910885}, {1.69337, -199.0798534114}, {
|
|
|
|
1.74628, -199.073970804}}]}, {
|
2022-04-22 11:43:01 +02:00
|
|
|
Hue[0.1421359549995791, 0.6, 0.6],
|
|
|
|
Directive[
|
|
|
|
PointSize[0.009166666666666668],
|
|
|
|
CapForm["Butt"],
|
|
|
|
AbsoluteThickness[1.6],
|
|
|
|
Thickness[0.01],
|
|
|
|
RGBColor[0, 0, 1]],
|
|
|
|
Line[CompressedData["
|
2022-04-25 14:17:16 +02:00
|
|
|
1:eJxTTMoPSmViYGAQB2IQHaLB1XH/zEd7BhB4kHEATDN8si8wVJ6ZCuSngcEn
|
|
|
|
e0+BtDbBhxkHzp4BgU/219JPX1kD5BuDwWf7sse8p9UfZRyYNRMEPttzTih8
|
|
|
|
2PkIZt4X+4uVOf43H8HM+2Iv+MOmUPgxzLwv9oFuG1V8H8PM+2qfGBLsU/oY
|
|
|
|
Zt5X+01JiaJdj2HmfbPncVdOnfwYZt43ex0WkfOL4OZ9s783KU9mA9y87/bb
|
|
|
|
JiTzbYKb991ePYWVdx3cvB/27NVREsvg5v2wX6agGjkZbt4P+/lT9n9rhJv3
|
|
|
|
03428+OUbLh5P+1PFTvsCYWb98v+rvpzVzu4eb/sV16/ul0eyAcAl5ux3w==
|
|
|
|
|
2022-04-22 11:43:01 +02:00
|
|
|
"]]}, {
|
|
|
|
Hue[0.37820393249936934`, 0.6, 0.6],
|
|
|
|
Directive[
|
|
|
|
PointSize[0.009166666666666668],
|
|
|
|
CapForm["Butt"],
|
|
|
|
AbsoluteThickness[1.6],
|
|
|
|
Thickness[0.01],
|
|
|
|
GrayLevel[0]],
|
|
|
|
Line[CompressedData["
|
2022-04-25 14:17:16 +02:00
|
|
|
1:eJxTTMoPSmViYGCQBGIQPYur2ZXn/0d7BhB4kHEATDN8shfl/fSaEchPA4NP
|
|
|
|
9vkOr/avA/LPngGBT/aLq+em2T3MOGAMBp/tZ/upP94C5M+aCQKf7avUuJaK
|
|
|
|
PoKZ98Xe10dhffIjmHlf7Dtf1U9a+Ahm3hd79S3r+i4+gpn31f6WV/fMr49g
|
|
|
|
5n21v2D2N4P/Mcy8b/aHV5+uUngMM++bfdR9e2mtxzDzvtnvi/mdpfsYZt53
|
|
|
|
+6syQSnaj2HmfbfP3Oj1QAVu3g97Oy2L2VJw837Yy4V/tuCFm/fDfpbmdI+/
|
|
|
|
cPf9tJ+lvN/9Ndx9P+2dQ32WXof795d9pNfGw4fg/v1l/8vqxq81cP/+st+8
|
|
|
|
+uDMaXDzfts/+/nteT2QDwBngMrU
|
2022-04-22 11:43:01 +02:00
|
|
|
"]]}, {
|
|
|
|
Hue[0.6142719099991583, 0.6, 0.6],
|
|
|
|
Directive[
|
|
|
|
PointSize[0.009166666666666668],
|
|
|
|
CapForm["Butt"],
|
|
|
|
AbsoluteThickness[1.6],
|
|
|
|
Thickness[0.01],
|
|
|
|
GrayLevel[0.5]],
|
|
|
|
Line[CompressedData["
|
2022-04-25 14:17:16 +02:00
|
|
|
1:eJxTTMoPSmViYGCQBGIQPXWtqv38fx/tGUDgQcYBMM3wyd54o8wJJiA/DQw+
|
|
|
|
2f848mXJeiD/7BkQ+GTft/9jiP3DjAPGYPDZfvrlj7e2AvmzZoLAZ/vMsyHL
|
|
|
|
xB7BzPtiX3v64c6URzDzvtjPLV+6bNEjmHlf7O9GKq259Ahm3lf7ecfMD3x7
|
|
|
|
BDPvq71A3PkZAo9h5n2zd9m5cbPiY5h53+wLW9RjtR/DzPtmn8ByfqveY5h5
|
|
|
|
3+03HPi6XecxzLzv9vn5M23U4Ob9sH8kx8QgAzfvh/0Bvj9L+eDm/bB/Xj9l
|
|
|
|
7z+4+37af1SKOPIG7r6f9ueVJTRvwv37y95hpanfEbh/f9lnSXR2r4P795d9
|
|
|
|
8yEOgxlw837br/4d19wI5AMAKYrM7g==
|
2022-04-22 11:43:01 +02:00
|
|
|
"]]}}}, {{}, {}}}, {
|
|
|
|
DisplayFunction -> Identity, DisplayFunction -> Identity, AspectRatio ->
|
|
|
|
1, Axes -> {False, False}, AxesLabel -> {None, None},
|
|
|
|
AxesOrigin -> {1.1, -199.}, BaseStyle -> 18, DisplayFunction :>
|
|
|
|
Identity, Frame -> {{True, True}, {True, True}}, FrameLabel -> {{
|
|
|
|
Style[
|
|
|
|
"\!\(\*StyleBox[\"E\",FontSlant->\"Italic\"]\)(F-F) (hartree)",
|
|
|
|
FontSize -> 20], None}, {
|
|
|
|
Style[
|
|
|
|
"\!\(\*SubscriptBox[\(R\), \(F - F\)]\) (\[Angstrom])", FontSize ->
|
|
|
|
20], None}}, FrameStyle -> Automatic,
|
|
|
|
FrameTicks -> {{Automatic, Automatic}, {Automatic, Automatic}},
|
|
|
|
GridLines -> {Automatic, Automatic}, GridLinesStyle -> Directive[
|
|
|
|
GrayLevel[0.5, 0.4]], ImageSize -> 500,
|
|
|
|
LabelStyle -> {FontFamily -> "Times"},
|
|
|
|
Method -> {
|
|
|
|
"OptimizePlotMarkers" -> True, "OptimizePlotMarkers" -> True,
|
|
|
|
"CoordinatesToolOptions" -> {"DisplayFunction" -> ({
|
|
|
|
Identity[
|
|
|
|
Part[#, 1]],
|
|
|
|
Identity[
|
|
|
|
Part[#, 2]]}& ), "CopiedValueFunction" -> ({
|
|
|
|
Identity[
|
|
|
|
Part[#, 1]],
|
|
|
|
Identity[
|
2022-04-25 14:17:16 +02:00
|
|
|
Part[#, 2]]}& )}}, PlotRange -> {{1.1, 1.65}, {-199.125, -199}},
|
2022-04-22 11:43:01 +02:00
|
|
|
PlotRangeClipping -> True, PlotRangePadding -> {{0, 0}, {0, 0}},
|
|
|
|
Ticks -> {Automatic, Automatic}}],
|
|
|
|
Placed[
|
|
|
|
Unevaluated[
|
|
|
|
PointLegend[{
|
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2022-04-22 11:43:01 +02:00
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Cell[180317, 4685, 209, 4, 67, "Subsection",ExpressionUUID->"be30329f-f9ba-4527-8163-186a874e9a90"],
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2022-04-22 11:43:01 +02:00
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Cell[CellGroupData[{
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2022-04-25 14:17:16 +02:00
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Cell[180551, 4693, 2753, 68, 428, "Input",ExpressionUUID->"f9d1d811-7b3a-44d3-b420-393dada6ea65"],
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Cell[183307, 4763, 31914, 682, 603, "Output",ExpressionUUID->"fb5e6ae1-aefb-439e-8ce7-f283f0689c64"]
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2022-04-22 11:43:01 +02:00
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}, Open ]]
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}, Open ]],
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|
|
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Cell[CellGroupData[{
|
2022-04-25 14:17:16 +02:00
|
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Cell[215270, 5451, 234, 4, 67, "Subsection",ExpressionUUID->"b576bbe1-e0d5-4a51-8d3b-2434b8b2ae25"],
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2022-04-22 11:43:01 +02:00
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Cell[CellGroupData[{
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2022-04-25 14:17:16 +02:00
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Cell[215529, 5459, 2853, 69, 428, "Input",ExpressionUUID->"bc4814e5-4b2b-490c-a2dc-d6127cadc760"],
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Cell[218385, 5530, 31690, 679, 603, "Output",ExpressionUUID->"07a199ad-6c11-4c78-aaec-1c6afff5c9df"]
|
2022-04-21 16:23:20 +02:00
|
|
|
}, Open ]]
|
|
|
|
}, Open ]],
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|
|
Cell[CellGroupData[{
|
2022-04-25 14:17:16 +02:00
|
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Cell[250124, 6215, 363, 6, 67, "Subsection",ExpressionUUID->"272281da-f01b-4205-abfb-106f716d1032"],
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2022-04-21 16:23:20 +02:00
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|
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Cell[CellGroupData[{
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2022-04-25 14:17:16 +02:00
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Cell[250512, 6225, 3056, 72, 428, "Input",ExpressionUUID->"0325c54f-e0a6-4ffb-9073-128cca96c7c8"],
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Cell[253571, 6299, 26874, 576, 603, "Output",ExpressionUUID->"91b903be-96d6-43ce-9ed3-b6d406dd0fca"]
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2022-04-21 16:23:20 +02:00
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|
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}, Open ]]
|
|
|
|
}, Open ]],
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|
|
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Cell[CellGroupData[{
|
2022-04-25 14:17:16 +02:00
|
|
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Cell[280494, 6881, 311, 5, 67, "Subsection",ExpressionUUID->"dcd27f4a-b467-4baa-b0e4-52959dd6f7c7"],
|
2022-04-21 16:23:20 +02:00
|
|
|
Cell[CellGroupData[{
|
2022-04-25 14:17:16 +02:00
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|
Cell[280830, 6890, 2956, 70, 428, "Input",ExpressionUUID->"3fcffcc6-b9d3-4697-8d58-d3a84ecff982"],
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Cell[283789, 6962, 31975, 684, 603, "Output",ExpressionUUID->"ad0f4f85-d42d-45d7-83a7-6bb8ef49a4fa"]
|
2022-04-21 16:23:20 +02:00
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|
|
}, Open ]]
|
|
|
|
}, Open ]],
|
|
|
|
Cell[CellGroupData[{
|
2022-04-25 14:17:16 +02:00
|
|
|
Cell[315813, 7652, 290, 5, 67, "Subsection",ExpressionUUID->"f0c9d32f-1cf6-4963-b037-ebcecddf08e2"],
|
2022-04-21 16:23:20 +02:00
|
|
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Cell[CellGroupData[{
|
2022-04-25 14:17:16 +02:00
|
|
|
Cell[316128, 7661, 2962, 70, 428, "Input",ExpressionUUID->"79fbfb0c-3c24-4b0e-bc5e-7c6e8de64c39"],
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|
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|
Cell[319093, 7733, 31927, 682, 623, "Output",ExpressionUUID->"e5306b93-d702-4dfe-aeb9-fa3981017bf8"]
|
2022-02-23 12:05:42 +01:00
|
|
|
}, Open ]]
|
2022-02-18 10:00:14 +01:00
|
|
|
}, Open ]]
|
2022-04-15 16:26:11 +02:00
|
|
|
}, Open ]]
|
2022-01-17 15:37:35 +01:00
|
|
|
}
|
|
|
|
]
|
|
|
|
*)
|
|
|
|
|