ASE database

ID Formula no_equ_18 no_equ_4
1 Cu54Li - ratio:1,dipole:-2.353,distance:1.877,ads_E:-2.141
2 BeCu54 ratio:1.6,dipole:-0.00466727,distance:7.61014,ads_E:-0.0017761 ratio:1,dipole:0.00345513,distance:0.973808,ads_E:-2.95616
3 Cu54B - ratio:1.000,dipole:0.557,distance:0.353,ads_E:-5.662
4 Cu54C ratio:1.6,dipole:3.20521,distance:6.61329,ads_E:-0.0862335 ratio:1,dipole:0.52283,distance:0.266163,ads_E:-6.42427
5 Cu54N ratio:1.55,dipole:0.009,distance:6.168,ads_E:-0.002 ratio:1,dipole:0.368,distance:0.386,ads_E:-4.725
6 Cu54O - ratio:1.000,dipole:0.486,distance:0.778,ads_E:-5.406
7 Cu54F - ratio:1.000,dipole:0.693,distance:1.239,ads_E:-4.335
8 Cu54Ar ratio:1.24,dipole:0.002,distance:6.801,ads_E:-0.005 ratio:0.96,dipole:-0.291,distance:3.002,ads_E:0.057