ASE database

ID Formula no_equ_15 str_E no_equ_17 no_equ_18 Mass Age
1 Cu54Li ratio:1.7,dipole:-2.867,distance:10.224,ads_E:-0.066 -193.113 - - 3438.424 13M
2 BeCu54 ratio:1.45,dipole:-0.0224294,distance:5.95106,ads_E:-0.00714774 -193.566 ratio:1.55,dipole:-0.00631543,distance:7.10066,ads_E:-0.00261613 ratio:1.6,dipole:-0.00466727,distance:7.61014,ads_E:-0.0017761 3440.496 13M
3 Cu54B ratio:1.900,dipole:-0.558,distance:9.794,ads_E:-0.180 -196.413 ratio:2.100,dipole:-0.833,distance:11.891,ads_E:-0.007 - 3442.294 13M
4 Cu54C ratio:1.45,dipole:2.19263,distance:4.95146,ads_E:-0.182345 -198.094 ratio:1.55,dipole:3.07149,distance:5.99264,ads_E:-0.095025 ratio:1.6,dipole:3.20521,distance:6.61329,ads_E:-0.0862335 3443.495 13M
5 Cu54N ratio:1.4,dipole:-0.095,distance:4.680,ads_E:-0.016 -198.315 ratio:1.5,dipole:0.030,distance:5.736,ads_E:-0.004 ratio:1.55,dipole:0.009,distance:6.168,ads_E:-0.002 3445.491 13M
6 Cu54O ratio:1.900,dipole:6.642,distance:10.576,ads_E:-0.174 -197.510 - - 3447.483 13M
7 Cu54F ratio:1.900,dipole:13.468,distance:11.427,ads_E:-0.666 -195.280 - - 3450.482 13M
8 Cu54Ar ratio:1.18,dipole:0.006,distance:5.987,ads_E:-0.007 -190.598 ratio:1.22,dipole:0.004,distance:6.530,ads_E:-0.006 ratio:1.24,dipole:0.002,distance:6.801,ads_E:-0.005 3471.432 13M