seniority/N2_cc-pvdz/pes_cisd_g16.dat
2021-04-26 13:45:27 +02:00

26 lines
675 B
Plaintext

0.7 -107.83227021
0.75 -108.30715362
0.8 -108.64352566
0.85 -108.87768133
0.9 -109.03626423
0.95 -109.13902278
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1.1 -109.24251841
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1.2 -109.22116133
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1.4 -109.10661317
1.5 -109.04122047
1.6 -108.97846459
1.7 -108.92047432
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2.0 -108.77932082
2.1 -108.74249782
2.2 -108.71004501
2.3 -108.68145475
2.4 -108.65623814
2.5 -108.63396162
2.6 -108.61423973