ASE database

Displaying rows 1-25 out of 127

↓ ID ✕	Formula ✕	Volume ✕	Username ✕	Dipole_val ✕	no_equ_15 ✕	ads_site ✕	Mass ✕	slab_E ✕
1	Cu₅₄Li	1730.483	hecc	-2.989	ratio:1.7,dipole:-2.867,distance:10.224,ads_E:-0.066	f	3438.424	-190.592
2	BeCu₅₄	1730.483	hecc	-0.069	ratio:1.45,dipole:-0.0224294,distance:5.95106,ads_E:-0.00714774	f	3440.496	-190.592
3	Cu₅₄B	1730.483	hecc	0.558	ratio:1.900,dipole:-0.558,distance:9.794,ads_E:-0.180	f	3442.294	-190.592
4	Cu₅₄C	1730.483	hecc	0.431	ratio:1.45,dipole:2.19263,distance:4.95146,ads_E:-0.182345	f	3443.495	-190.592
5	Cu₅₄N	1730.483	hecc	0.356	ratio:1.4,dipole:-0.095,distance:4.680,ads_E:-0.016	f	3445.491	-190.592
6	Cu₅₄O	1730.483	hecc	0.473	ratio:1.900,dipole:6.642,distance:10.576,ads_E:-0.174	f	3447.483	-190.592
7	Cu₅₄F	1730.483	hecc	0.677	ratio:1.900,dipole:13.468,distance:11.427,ads_E:-0.666	f	3450.482	-190.592
8	Cu₅₄Ar	1730.483	hecc	-0.049	ratio:1.18,dipole:0.006,distance:5.987,ads_E:-0.007	f	3471.432	-190.592