srDFT_SC/new/N2_avtz/plots/data_DFT_avtzE_tot
2019-11-20 15:52:45 +01:00

12 lines
866 B
Plaintext

1.6 -109.04436903 -109.085207941 -109.090624479 -109.090732257 -109.1967
1.75 -109.25229745 -109.28996126 -109.295671993 -109.295781745 -109.4116
1.9 -109.34985796 -109.384951668 -109.390874407 -109.390987528 -109.506
2.075 -109.38241351 -109.415128406 -109.421212356 -109.421331104 -109.534
2.25 -109.36733223 -109.398182802 -109.404355179 -109.404481523 -109.5156
2.75 -109.24164328 -109.26881143 -109.274964887 -109.275126969 -109.3875
3.5 -109.09354538 -109.11618069 -109.12164132 -109.121905685 -109.2457
4.0 -109.05550914 -109.076150828 -109.081036225 -109.081371816 -109.2051
5.0 -109.03816099 -109.058207775 -109.0627174 -109.063403985 -109.1781
7.0 -109.03542786 -109.055085315 -109.059485705 -109.05986722 -109.1704
10.0 -109.03465301 -109.054219465 -109.058646642 -109.059010251 -109.1698