ASE database

Displaying rows 1-8 out of 8

↓ ID ✕	Formula ✕	no_equ_16 ✕	Maximum force ✕	no_equ_3 ✕
1	Cu₅₄Li	ratio:1.9,dipole:-3.128,distance:12.609,ads_E:-0.058	0.009	ratio:0.96,dipole:-1.624,distance:1.400,ads_E:-1.949
2	BeCu₅₄	ratio:1.5,dipole:-0.0113499,distance:6.50408,ads_E:-0.00416696	0.010	ratio:0.96,dipole:0.234375,distance:0.531386,ads_E:-2.83237
3	Cu₅₄B	ratio:2.000,dipole:-1.008,distance:10.843,ads_E:-0.007	0.005	ratio:0.960,dipole:0.398,distance:-0.066,ads_E:-5.490
4	Cu₅₄C	ratio:1.51,dipole:2.9677,distance:5.57616,ads_E:-0.10513	0.010	ratio:0.96,dipole:0.291413,distance:-0.150308,ads_E:-6.20762
5	Cu₅₄N	ratio:1.45,dipole:0.007,distance:5.116,ads_E:-0.007	0.005	ratio:0.96,dipole:0.160,distance:-0.035,ads_E:-4.570
6	Cu₅₄O	ratio:2.100,dipole:4.187,distance:12.753,ads_E:-0.168	0.008	ratio:0.960,dipole:0.131,distance:0.342,ads_E:-5.226
7	Cu₅₄F	-	0.006	ratio:0.960,dipole:0.260,distance:0.787,ads_E:-4.090
8	Cu₅₄Ar	ratio:1.2,dipole:0.005,distance:6.259,ads_E:-0.006	0.007	ratio:0.94,dipole:-0.431,distance:2.731,ads_E:0.139