ASE database

ID Formula no_equ_26 no_equ_3 Magnetic moment
1 Cu54Li - ratio:0.96,dipole:-1.624,distance:1.400,ads_E:-1.949 0.000
2 BeCu54 - ratio:0.96,dipole:0.234375,distance:0.531386,ads_E:-2.83237 -0.000
3 Cu54B - ratio:0.960,dipole:0.398,distance:-0.066,ads_E:-5.490 0.000
4 Cu54C - ratio:0.96,dipole:0.291413,distance:-0.150308,ads_E:-6.20762 -0.000
5 Cu54N - ratio:0.96,dipole:0.160,distance:-0.035,ads_E:-4.570 -0.000
6 Cu54O - ratio:0.960,dipole:0.131,distance:0.342,ads_E:-5.226 0.000
7 Cu54F - ratio:0.960,dipole:0.260,distance:0.787,ads_E:-4.090 -0.000
8 Cu54Ar ratio:1.4,dipole:0.000,distance:8.972,ads_E:-0.005 ratio:0.94,dipole:-0.431,distance:2.731,ads_E:0.139 -0.000