ASE database

Displaying rows 1-8 out of 8
↓ ID ✕ Formula ✕ no_equ_10 ✕ no_equ_2 ✕ no_equ_7 ✕ ads_site ✕
1 Cu54Li ratio:1.17,dipole:-3.222,distance:3.904,ads_E:-0.582 ratio:0.93,dipole:-1.125,distance:1.042,ads_E:-1.567 ratio:1.1,dipole:-4.039,distance:3.069,ads_E:-1.290 f
2 BeCu54 ratio:1.2,dipole:-0.359907,distance:3.18592,ads_E:-0.372501 ratio:0.93,dipole:0.340153,distance:0.19957,ads_E:-2.58415 ratio:1.1,dipole:-0.434967,distance:2.07986,ads_E:-1.97799 f
3 Cu54B ratio:1.200,dipole:0.935,distance:2.451,ads_E:-2.045 ratio:0.930,dipole:0.209,distance:-0.381,ads_E:-5.180 ratio:1.100,dipole:0.778,distance:1.402,ads_E:-4.794 f
4 Cu54C ratio:1.2,dipole:1.54212,distance:2.34852,ads_E:-2.29339 ratio:0.93,dipole:0.104359,distance:-0.462661,ads_E:-5.77067 ratio:1.1,dipole:1.00519,distance:1.30734,ads_E:-5.4061 f
5 Cu54N ratio:1.2,dipole:1.380,distance:2.488,ads_E:-0.433 ratio:0.93,dipole:-0.001,distance:-0.350,ads_E:-4.156 ratio:1.1,dipole:1.088,distance:1.437,ads_E:-3.705 f
6 Cu54O ratio:1.200,dipole:3.021,distance:2.955,ads_E:-0.945 ratio:0.930,dipole:-0.058,distance:0.015,ads_E:-4.909 ratio:1.100,dipole:1.502,distance:1.866,ads_E:-3.941 f
7 Cu54F ratio:1.250,dipole:6.761,distance:4.069,ads_E:-1.287 ratio:0.930,dipole:0.015,distance:0.447,ads_E:-3.637 ratio:1.100,dipole:3.086,distance:2.371,ads_E:-3.138 f
8 Cu54Ar ratio:1.08,dipole:0.005,distance:4.631,ads_E:-0.014 ratio:0.92,dipole:-0.596,distance:2.460,ads_E:0.278 ratio:1.02,dipole:-0.049,distance:3.817,ads_E:-0.015 f