ASE database

Displaying rows 1-8 out of 8
↓ ID ✕ Formula ✕ slab_E ✕ Mass ✕ no_equ_1 ✕
1 Cu54Li -190.592 3438.424 ratio:0.9,dipole:-0.645,distance:0.684,ads_E:-1.046
2 BeCu54 -190.592 3440.496 ratio:0.9,dipole:0.302883,distance:-0.132247,ads_E:-2.36046
3 Cu54B -190.592 3442.294 ratio:0.900,dipole:-0.012,distance:-0.696,ads_E:-4.781
4 Cu54C -190.592 3443.495 ratio:0.9,dipole:-0.0331232,distance:-0.775014,ads_E:-5.11493
5 Cu54N -190.592 3445.491 ratio:0.9,dipole:-0.149,distance:-0.666,ads_E:-3.448
6 Cu54O -190.592 3447.483 ratio:0.900,dipole:-0.175,distance:-0.311,ads_E:-4.372
7 Cu54F -190.592 3450.482 ratio:0.900,dipole:-0.137,distance:0.107,ads_E:-3.084
8 Cu54Ar -190.592 3471.432 ratio:0.9,dipole:-0.757,distance:2.324,ads_E:0.500