ASE database

ID Formula Volume no_equ_19 no_equ_7
1 Cu54Li 1730.483 - ratio:1.1,dipole:-4.039,distance:3.069,ads_E:-1.290
2 BeCu54 1730.483 - ratio:1.1,dipole:-0.434967,distance:2.07986,ads_E:-1.97799
3 Cu54B 1730.483 - ratio:1.100,dipole:0.778,distance:1.402,ads_E:-4.794
4 Cu54C 1730.483 ratio:1.8,dipole:3.74248,distance:8.59558,ads_E:-0.0684837 ratio:1.1,dipole:1.00519,distance:1.30734,ads_E:-5.4061
5 Cu54N 1730.483 ratio:1.6,dipole:0.009,distance:6.693,ads_E:-0.002 ratio:1.1,dipole:1.088,distance:1.437,ads_E:-3.705
6 Cu54O 1730.483 - ratio:1.100,dipole:1.502,distance:1.866,ads_E:-3.941
7 Cu54F 1730.483 - ratio:1.100,dipole:3.086,distance:2.371,ads_E:-3.138
8 Cu54Ar 1730.483 ratio:1.26,dipole:0.002,distance:7.073,ads_E:-0.005 ratio:1.02,dipole:-0.049,distance:3.817,ads_E:-0.015