seniority/N2_cc-pvdz/pes_orbital_energy_13.dat
2021-04-26 13:45:27 +02:00

40 lines
473 B
Plaintext

0.7 0.71957
0.75 0.73249
0.8 0.75674
0.85 0.77986
0.9 0.80169
0.95 0.82204
1.0 0.84078
1.05 0.85777
1.1 0.87287
1.15 0.88598
1.2 0.89699
1.3 0.91245
1.4 0.91920
1.5 0.91835
1.6 0.91213
1.7 0.90315
1.8 0.89364
1.9 0.88764
2.0 0.89596
2.1 0.90405
2.2 0.91167
2.3 0.91874
2.4 0.91593
2.5 0.88865
2.6 0.87496
2.7 0.87852
2.8 0.88255
2.9 0.88684
3.0 0.89121
3.1 0.89554
3.2 0.89970
3.3 0.90362
3.4 0.90723
3.5 0.91051
3.6 0.91342
3.7 0.91597
3.8 0.91817
3.9 0.92004
4.0 0.92161