diff --git a/Manuscript/H2_BSE.pdf b/Manuscript/H2_BSE.pdf index 25fa5b7..064cdd1 100644 Binary files a/Manuscript/H2_BSE.pdf and b/Manuscript/H2_BSE.pdf differ diff --git a/Manuscript/sfBSE.tex b/Manuscript/sfBSE.tex index 6a70dfb..58d91a2 100644 --- a/Manuscript/sfBSE.tex +++ b/Manuscript/sfBSE.tex @@ -819,15 +819,15 @@ Now, looking at the Table~\ref{tab:CBD_D4h} and comparing SF-BSE@{\GOWO} to SF-A Method & $1\,{}^3B_{1g}$ & $1\,{}^1B_{1g}$ & $2\,{}^1A_{1g}$ \\ \hline SF-TD-BLYP \fnm[3] & & & \\ - SF-TD-B3LYP \fnm[3] & & & \\ + SF-TD-B3LYP \fnm[3] &1.750 &2.260 &4.094 \\ SF-TD-BH\&HLYP\fnm[3] &1.583 &2.813 & 4.528\\ SF-CIS\fnm[1] & & & \\ EOM-SF-CCSD\fnm[1] &1.654 & 3.416&4.360 \\ EOM-SF-CCSD(fT)\fnm[1] & 1.516& 3.260&4.205 \\ EOM-SF-CCSD(dT)\fnm[1] &1.475 &3.215 &4.176 \\ - SF-ADC(2)-s\fnm[2] & 1.572& 3.201& 4.241\\ - SF-ADC(2)-x\fnm[2] &1.576 &3.134 &3.792 \\ - SF-ADC(3)\fnm[2] & 1.455&3.276 &4.328 \\ + SF-ADC(2)-s\fnm[2] & 1.573& 3.208& 4.247\\ + SF-ADC(2)-x\fnm[2] &1.576 &3.141 &3.796 \\ + SF-ADC(3)\fnm[2] & 1.456&3.285 &4.334 \\ SF-BSE@{\GOWO}\fnm[3] & 1.438 & 2.704 &4.540 \\ SF-dBSE@{\GOWO}\fnm[3] & 1.403 &2.883 &4.621 \\ \end{tabular} @@ -851,13 +851,13 @@ Now, looking at the Table~\ref{tab:CBD_D4h} and comparing SF-BSE@{\GOWO} to SF-A Method & $1\,{}^3A_{2g}$ & $2\,{}^1A_{1g}$ & $1\,{}^1B_{2g}$ \\ \hline SF-TD-BLYP \fnm[3] & & & \\ - SF-TD-B3LYP \fnm[3] & & & \\ - SF-TD-BH\&HLYP\fnm[3] & & & \\ + SF-TD-B3LYP \fnm[3] &-0.020 & 0.486& 0.547\\ + SF-TD-BH\&HLYP\fnm[3] &0.048 & 1.282&1.465 \\ SF-CIS\fnm[1] &0.317 & 3.125&2.650 \\ EOM-SF-CCSD\fnm[1] &0.369 & 1.824& 2.143\\ EOM-SF-CCSD(fT)\fnm[1] & 0.163&1.530 &1.921 \\ EOM-SF-CCSD(dT)\fnm[1] &0.098 &1.456 &1.853 \\ - SF-ADC(2)-s\fnm[2] & 0.265 & 1.658& 1.904 \\ + SF-ADC(2)-s\fnm[2] & 0.266& 1.664& 1.910 \\ SF-ADC(2)-x\fnm[2] & 0.217&1.123 &1.799 \\ SF-ADC(3)\fnm[2] &0.083 &1.621 &1.930 \\ SF-BSE@{\GOWO}\fnm[3] & -0.049 & 1.189 & 1.480 \\