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fix links in trex.org after renaming some sections
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trex.org
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trex.org
@ -348,7 +348,7 @@ prim_factor =
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(\mathbf{r}) dx\, dy\, dz \right]^{-1/2}. \]
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(\mathbf{r}) dx\, dy\, dz \right]^{-1/2}. \]
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In such a case, one should set the normalization of the shell (in
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In such a case, one should set the normalization of the shell (in
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the [[Basis set][Basis set]] section) to $\mathcal{N}_{z^2}$, which is the
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the [[Basis set (basis group)][Basis set]] section) to $\mathcal{N}_{z^2}$, which is the
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normalization factor of the atomic orbitals in spherical coordinates.
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normalization factor of the atomic orbitals in spherical coordinates.
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The normalization factor of the $xy$ function which should be
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The normalization factor of the $xy$ function which should be
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introduced here should be $\frac{\mathcal{N}_{xy}}{\mathcal{N}_{z^2}}$.
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introduced here should be $\frac{\mathcal{N}_{xy}}{\mathcal{N}_{z^2}}$.
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@ -375,7 +375,7 @@ prim_factor =
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#+end_src
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#+end_src
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:end:
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:end:
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** One-electron integrals (ao_1e_int group)
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** One-electron integrals (~ao_1e_int~ group)
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:PROPERTIES:
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:PROPERTIES:
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:CUSTOM_ID: ao_one_e
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:CUSTOM_ID: ao_one_e
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:END:
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:END:
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@ -418,7 +418,7 @@ prim_factor =
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#+end_src
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#+end_src
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:end:
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:end:
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** Two-electron integrals (ao_2e_int group)
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** Two-electron integrals (~ao_2e_int~ group)
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:PROPERTIES:
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:PROPERTIES:
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:CUSTOM_ID: ao_two_e
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:CUSTOM_ID: ao_two_e
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:END:
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:END:
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@ -484,7 +484,7 @@ prim_factor =
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#+end_src
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#+end_src
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:end:
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:end:
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** One-electron integrals (mo_1e_int group)
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** One-electron integrals (~mo_1e_int~ group)
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The operators as the same as those defined in the
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The operators as the same as those defined in the
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[[#ao_one_e][AO one-electron integrals section]]. Here, the integrals are given in
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[[#ao_one_e][AO one-electron integrals section]]. Here, the integrals are given in
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@ -516,10 +516,10 @@ prim_factor =
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#+end_src
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#+end_src
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:end:
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:end:
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** Two-electron integrals (mo_2e_int group)
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** Two-electron integrals (~mo_2e_int~ group)
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The operators as the same as those defined in the
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The operators as the same as those defined in the
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[[#ao_one_e][AO one-electron integrals section]]. Here, the integrals are given in
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[[#ao_two_e][AO two-electron integrals section]]. Here, the integrals are given in
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the basis of molecular orbitals.
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the basis of molecular orbitals.
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#+NAME: mo_2e_int
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#+NAME: mo_2e_int
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