ASE database

Displaying rows 1-8 out of 8

↓ ID ✕	Formula ✕	no_equ_3 ✕	no_equ_14 ✕
1	Cu₅₄Li	ratio:0.96,dipole:-1.624,distance:1.400,ads_E:-1.949	ratio:1.5,dipole:-2.645,distance:7.839,ads_E:-0.084
2	BeCu₅₄	ratio:0.96,dipole:0.234375,distance:0.531386,ads_E:-2.83237	ratio:1.4,dipole:-0.047443,distance:5.39803,ads_E:-0.0134448
3	Cu₅₄B	ratio:0.960,dipole:0.398,distance:-0.066,ads_E:-5.490	ratio:1.500,dipole:-0.465,distance:5.598,ads_E:-0.193
4	Cu₅₄C	ratio:0.96,dipole:0.291413,distance:-0.150308,ads_E:-6.20762	ratio:1.4,dipole:2.63066,distance:4.43087,ads_E:-0.175371
5	Cu₅₄N	ratio:0.96,dipole:0.160,distance:-0.035,ads_E:-4.570	ratio:1.36,dipole:-0.067,distance:4.254,ads_E:-0.030
6	Cu₅₄O	ratio:0.960,dipole:0.131,distance:0.342,ads_E:-5.226	ratio:1.550,dipole:3.996,distance:6.765,ads_E:-0.507
7	Cu₅₄F	ratio:0.960,dipole:0.260,distance:0.787,ads_E:-4.090	ratio:1.600,dipole:10.431,distance:8.031,ads_E:-0.769
8	Cu₅₄Ar	ratio:0.94,dipole:-0.431,distance:2.731,ads_E:0.139	ratio:1.16,dipole:0.006,distance:5.716,ads_E:-0.008