ASE database

Displaying rows 1-8 out of 8
↓ ID ✕ Formula ✕ no_equ_13 ✕ no_equ_11 ✕ no_equ_7 ✕ no_equ_19 ✕
1 Cu54Li ratio:1.35,dipole:-2.533,distance:6.051,ads_E:-0.126 ratio:1.25,dipole:-2.667,distance:4.858,ads_E:-0.244 ratio:1.1,dipole:-4.039,distance:3.069,ads_E:-1.290 -
2 BeCu54 ratio:1.35,dipole:-0.0991408,distance:4.845,ads_E:-0.0276465 ratio:1.25,dipole:-0.291055,distance:3.73895,ads_E:-0.152313 ratio:1.1,dipole:-0.434967,distance:2.07986,ads_E:-1.97799 -
3 Cu54B ratio:1.400,dipole:-0.694,distance:4.626,ads_E:-0.236 ratio:1.250,dipole:-0.107,distance:2.976,ads_E:-0.989 ratio:1.100,dipole:0.778,distance:1.402,ads_E:-4.794 -
4 Cu54C ratio:1.35,dipole:2.50975,distance:3.91028,ads_E:-0.271632 ratio:1.25,dipole:1.94527,distance:2.86911,ads_E:-0.945693 ratio:1.1,dipole:1.00519,distance:1.30734,ads_E:-5.4061 ratio:1.8,dipole:3.74248,distance:8.59558,ads_E:-0.0684837
5 Cu54N ratio:1.33,dipole:0.416,distance:3.855,ads_E:-0.042 ratio:1.25,dipole:0.908,distance:3.014,ads_E:-0.162 ratio:1.1,dipole:1.088,distance:1.437,ads_E:-3.705 ratio:1.6,dipole:0.009,distance:6.693,ads_E:-0.002
6 Cu54O ratio:1.350,dipole:3.982,distance:4.588,ads_E:-0.321 ratio:1.250,dipole:3.446,distance:3.499,ads_E:-0.537 ratio:1.100,dipole:1.502,distance:1.866,ads_E:-3.941 -
7 Cu54F ratio:1.550,dipole:9.933,distance:7.465,ads_E:-0.801 ratio:1.300,dipole:7.369,distance:4.635,ads_E:-1.125 ratio:1.100,dipole:3.086,distance:2.371,ads_E:-3.138 -
8 Cu54Ar ratio:1.14,dipole:0.008,distance:5.445,ads_E:-0.009 ratio:1.1,dipole:0.008,distance:4.902,ads_E:-0.012 ratio:1.02,dipole:-0.049,distance:3.817,ads_E:-0.015 ratio:1.26,dipole:0.002,distance:7.073,ads_E:-0.005