seniority/N2_cc-pvdz/pes_orbital_energy_16.dat
2021-04-26 13:45:27 +02:00

40 lines
473 B
Plaintext

0.7 1.23422
0.75 1.19629
0.8 1.16433
0.85 1.13725
0.9 1.11416
0.95 1.09438
1.0 1.07743
1.05 1.06291
1.1 1.05051
1.15 1.03997
1.2 1.03107
1.3 1.01735
1.4 1.00797
1.5 1.00179
1.6 0.99782
1.7 0.99527
1.8 0.99348
1.9 0.99195
2.0 0.99030
2.1 0.98825
2.2 0.98561
2.3 0.98229
2.4 0.97832
2.5 0.97380
2.6 0.96891
2.7 0.96385
2.8 0.95881
2.9 0.95398
3.0 0.95324
3.1 0.95633
3.2 0.95898
3.3 0.96115
3.4 0.96277
3.5 0.96376
3.6 0.96399
3.7 0.96334
3.8 0.96170
3.9 0.95908
4.0 0.95569