ASE database

Displaying rows 1-8 out of 8

↓ ID ✕	Formula ✕	Charge ✕	no_equ_15 ✕	no_equ_14 ✕
1	Cu₅₄Li	0.000	ratio:1.7,dipole:-2.867,distance:10.224,ads_E:-0.066	ratio:1.5,dipole:-2.645,distance:7.839,ads_E:-0.084
2	BeCu₅₄	0.000	ratio:1.45,dipole:-0.0224294,distance:5.95106,ads_E:-0.00714774	ratio:1.4,dipole:-0.047443,distance:5.39803,ads_E:-0.0134448
3	Cu₅₄B	0.000	ratio:1.900,dipole:-0.558,distance:9.794,ads_E:-0.180	ratio:1.500,dipole:-0.465,distance:5.598,ads_E:-0.193
4	Cu₅₄C	0.000	ratio:1.45,dipole:2.19263,distance:4.95146,ads_E:-0.182345	ratio:1.4,dipole:2.63066,distance:4.43087,ads_E:-0.175371
5	Cu₅₄N	0.000	ratio:1.4,dipole:-0.095,distance:4.680,ads_E:-0.016	ratio:1.36,dipole:-0.067,distance:4.254,ads_E:-0.030
6	Cu₅₄O	0.000	ratio:1.900,dipole:6.642,distance:10.576,ads_E:-0.174	ratio:1.550,dipole:3.996,distance:6.765,ads_E:-0.507
7	Cu₅₄F	0.000	ratio:1.900,dipole:13.468,distance:11.427,ads_E:-0.666	ratio:1.600,dipole:10.431,distance:8.031,ads_E:-0.769
8	Cu₅₄Ar	0.000	ratio:1.18,dipole:0.006,distance:5.987,ads_E:-0.007	ratio:1.16,dipole:0.006,distance:5.716,ads_E:-0.008