ASE database

ID Formula Maximum force Maximum stress no_equ_31 no_equ_7
1 Cu54Li 0.009 0.009 - ratio:1.1,dipole:-4.039,distance:3.069,ads_E:-1.290
2 BeCu54 0.010 0.008 - ratio:1.1,dipole:-0.434967,distance:2.07986,ads_E:-1.97799
3 Cu54B 0.005 0.008 - ratio:1.100,dipole:0.778,distance:1.402,ads_E:-4.794
4 Cu54C 0.010 0.008 - ratio:1.1,dipole:1.00519,distance:1.30734,ads_E:-5.4061
5 Cu54N 0.005 0.007 - ratio:1.1,dipole:1.088,distance:1.437,ads_E:-3.705
6 Cu54O 0.008 0.009 - ratio:1.100,dipole:1.502,distance:1.866,ads_E:-3.941
7 Cu54F 0.006 0.009 - ratio:1.100,dipole:3.086,distance:2.371,ads_E:-3.138
8 Cu54Ar 0.007 0.009 ratio:1.5,dipole:0.000,distance:10.329,ads_E:-0.005 ratio:1.02,dipole:-0.049,distance:3.817,ads_E:-0.015