ASE database

ID Formula ads_site no_equ_22 Maximum stress no_equ_23 no_equ_20 no_equ_18
1 Cu54Li f - 0.009 - - -
2 BeCu54 f - 0.008 - - ratio:1.6,dipole:-0.00466727,distance:7.61014,ads_E:-0.0017761
3 Cu54B f - 0.008 - - -
4 Cu54C f - 0.008 - ratio:2.1,dipole:5.51535,distance:11.7191,ads_E:-0.0591715 ratio:1.6,dipole:3.20521,distance:6.61329,ads_E:-0.0862335
5 Cu54N f - 0.007 - - ratio:1.55,dipole:0.009,distance:6.168,ads_E:-0.002
6 Cu54O f - 0.009 - - -
7 Cu54F f - 0.009 - - -
8 Cu54Ar f ratio:1.32,dipole:0.002,distance:7.887,ads_E:-0.005 0.009 ratio:1.34,dipole:0.001,distance:8.158,ads_E:-0.005 ratio:1.28,dipole:0.001,distance:7.344,ads_E:-0.005 ratio:1.24,dipole:0.002,distance:6.801,ads_E:-0.005