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CCSD values in TBEs table

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EnzoMonino 2022-04-08 10:07:41 +02:00
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Manuscript/CBD-SI.tex
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@ -184,7 +184,7 @@ CASPT2(12,12) & $-0.42$& $0.018$ & $0.058$ & $-0.106$ & $0.039$ & $0.038$ & $-0
%XMS-CASPT2(12,12) & & & & $-0.090$ & & & \\ %XMS-CASPT2(12,12) & & & & $-0.090$ & & & \\
SC-NEVPT2(12,12) & $-0.64$ & $0.039$ & $0.063$ & $-0.063$ & $0.021$ & $0.046$ & $-0.142$ \\ SC-NEVPT2(12,12) & $-0.64$ & $0.039$ & $0.063$ & $-0.063$ & $0.021$ & $0.046$ & $-0.142$ \\
PC-NEVPT2(12,12) & $-0.65$ & $0.000$ & $-0.062$ & $-0.093$ & $-0.013$ & $-0.024$ & $-0.278$ \\[0.1cm] PC-NEVPT2(12,12) & $-0.65$ & $0.000$ & $-0.062$ & $-0.093$ & $-0.013$ & $-0.024$ & $-0.278$ \\[0.1cm]
CCSD & $0.95$ & & & & $-0.059$ & $0.100$ & \\ CCSD & $0.95$ & $-0.145$ & $0.067$ & & $-0.059$ & $0.100$ & \\
CC3 & $-1.05$ & $-0.060$ & $-0.006$ & $0.628$ & & $0.162$ & $0.686$ \\ CC3 & $-1.05$ & $-0.060$ & $-0.006$ & $0.628$ & & $0.162$ & $0.686$ \\
CCSDT & $-0.25$ & $-0.051$ & $0.014$ & $0.280$ & $0.005$ & $0.131$ & $0.503$ \\ CCSDT & $-0.25$ & $-0.051$ & $0.014$ & $0.280$ & $0.005$ & $0.131$ & $0.503$ \\
CC4 & $-0.11$ & & $0.003$ & $-0.006$ & & $0.011$ & $-0.013$ \\ CC4 & $-0.11$ & & $0.003$ & $-0.006$ & & $0.011$ & $-0.013$ \\