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CBS values

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Pierre-Francois Loos 2019-05-16 14:43:16 +02:00
parent 99ec8dfa83
commit 72ddc17b86
2 changed files with 8 additions and 0 deletions
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Manuscript/Ex-srDFT.tex
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@ -146,6 +146,11 @@ In the present study, we rely on the recently proposed short-range density-funct
& -39.07647(1) & 0.390
& -39.03964(3) & 1.392
& -38.99867(1) & 2.507 \\
& CBS & -39.09111
& -39.07682 & 0.389
& -39.04000 & 1.391
& -38.99904 & 2.505 \\
\\
exFCI+LDA & AVDZ & -39.07450(1)
& -39.06213(1) & 0.337
& -39.02233(1) & 1.420
@ -158,6 +163,7 @@ In the present study, we rely on the recently proposed short-range density-funct
& -39.07959(2) & 0.370
& -39.04267(1) & 1.375
& -39.00135(1) & 2.499 \\
\\
exFCI+PBE & AVDZ & -39.07282(1)
& -39.06150(1) & 0.308
& -39.02181(1) & 1.388
@ -170,6 +176,7 @@ In the present study, we rely on the recently proposed short-range density-funct
& -39.07885(2) & 0.371
& -39.04193(1) & 1.375
& -39.00066(1) & 2.498 \\
\\
exFCI+PBEot & AVDZ & -39.06924(1)
& -39.05651(1) & 0.347
& -39.01777(1) & 1.401
@ -182,6 +189,7 @@ In the present study, we rely on the recently proposed short-range density-funct
& -39.07795(2) & 0.379
& -39.04124(1) & 1.378
& -39.00044(1) & 2.489 \\
\\
SHCI & AVQZ & -39.08849(1)
& -39.07404(1) & 0.393
& -39.03711(1) & 1.398