ASE database

Displaying rows 1-8 out of 8

↓ ID ✕	Formula ✕	no_equ_7 ✕	no_equ_1 ✕
1	Cu₅₄Li	ratio:1.1,dipole:-4.039,distance:3.069,ads_E:-1.290	ratio:0.9,dipole:-0.645,distance:0.684,ads_E:-1.046
2	BeCu₅₄	ratio:1.1,dipole:-0.434967,distance:2.07986,ads_E:-1.97799	ratio:0.9,dipole:0.302883,distance:-0.132247,ads_E:-2.36046
3	Cu₅₄B	ratio:1.100,dipole:0.778,distance:1.402,ads_E:-4.794	ratio:0.900,dipole:-0.012,distance:-0.696,ads_E:-4.781
4	Cu₅₄C	ratio:1.1,dipole:1.00519,distance:1.30734,ads_E:-5.4061	ratio:0.9,dipole:-0.0331232,distance:-0.775014,ads_E:-5.11493
5	Cu₅₄N	ratio:1.1,dipole:1.088,distance:1.437,ads_E:-3.705	ratio:0.9,dipole:-0.149,distance:-0.666,ads_E:-3.448
6	Cu₅₄O	ratio:1.100,dipole:1.502,distance:1.866,ads_E:-3.941	ratio:0.900,dipole:-0.175,distance:-0.311,ads_E:-4.372
7	Cu₅₄F	ratio:1.100,dipole:3.086,distance:2.371,ads_E:-3.138	ratio:0.900,dipole:-0.137,distance:0.107,ads_E:-3.084
8	Cu₅₄Ar	ratio:1.02,dipole:-0.049,distance:3.817,ads_E:-0.015	ratio:0.9,dipole:-0.757,distance:2.324,ads_E:0.500