seniority/N2_cc-pvdz/pes_CIo2.5.dat

40 lines
863 B
Plaintext
Raw Normal View History

2021-11-03 18:08:46 +01:00
0.7 -107.83625301
0.75 -108.31168523
0.8 -108.64869532
0.85 -108.88358726
0.9 -109.04301474
0.95 -109.14673680
1.0 -109.20952711
1.05 -109.24248487
1.1 -109.25395180
1.15 -109.25018004
1.2 -109.23584201
1.3 -109.18854232
1.4 -109.13053672
1.5 -109.07175550
1.6 -109.01694264
1.7 -108.96821741
1.8 -108.92617594
1.9 -108.89054259
2.0 -108.86058682
2.1 -108.83538598
2.2 -108.81401108
2.3 -108.79596419
2.4 -108.78091985
2.5 -108.76764260
2.6 -108.75601389
2.7 -108.74585950
2.8 -108.73698349
2.9 -108.72921785
3.0 -108.72241876
3.1 -108.71646255
3.2 -108.71124048
3.3 -108.70665896
3.4 -108.70263557
3.5 -108.69909574
3.6 -108.69597257
3.7 -108.69320400
3.8 -108.69073643
3.9 -108.68853155
4.0 -108.68657244