ASE database

Displaying rows 1-25 out of 594
↓ ID ✕ Formula ✕ Magnetic moment ✕ Maximum force ✕ Mass ✕ no_equ_2 ✕ ads_E ✕
1 Cu54Li 0.000 0.009 3438.424 ratio:0.93,dipole:-1.125,distance:1.042,ads_E:-1.567 -2.222
2 BeCu54 -0.000 0.010 3440.496 ratio:0.93,dipole:0.340153,distance:0.19957,ads_E:-2.58415 -2.934
3 Cu54B 0.000 0.005 3442.294 ratio:0.930,dipole:0.209,distance:-0.381,ads_E:-5.180 -5.472
4 Cu54C -0.000 0.010 3443.495 ratio:0.93,dipole:0.104359,distance:-0.462661,ads_E:-5.77067 -6.254
5 Cu54N -0.000 0.005 3445.491 ratio:0.93,dipole:-0.001,distance:-0.350,ads_E:-4.156 -4.599
6 Cu54O 0.000 0.008 3447.483 ratio:0.930,dipole:-0.058,distance:0.015,ads_E:-4.909 -5.385
7 Cu54F -0.000 0.006 3450.482 ratio:0.930,dipole:0.015,distance:0.447,ads_E:-3.637 -4.264
8 Cu54Ar -0.000 0.007 3471.432 ratio:0.92,dipole:-0.596,distance:2.460,ads_E:0.278 0.020