ASE database

Displaying rows 1-8 out of 8
↓ ID ✕ Formula ✕ no_equ_3 ✕ no_equ_14 ✕ no_equ_7 ✕
1 Cu54Li ratio:0.96,dipole:-1.624,distance:1.400,ads_E:-1.949 ratio:1.5,dipole:-2.645,distance:7.839,ads_E:-0.084 ratio:1.1,dipole:-4.039,distance:3.069,ads_E:-1.290
2 BeCu54 ratio:0.96,dipole:0.234375,distance:0.531386,ads_E:-2.83237 ratio:1.4,dipole:-0.047443,distance:5.39803,ads_E:-0.0134448 ratio:1.1,dipole:-0.434967,distance:2.07986,ads_E:-1.97799
3 Cu54B ratio:0.960,dipole:0.398,distance:-0.066,ads_E:-5.490 ratio:1.500,dipole:-0.465,distance:5.598,ads_E:-0.193 ratio:1.100,dipole:0.778,distance:1.402,ads_E:-4.794
4 Cu54C ratio:0.96,dipole:0.291413,distance:-0.150308,ads_E:-6.20762 ratio:1.4,dipole:2.63066,distance:4.43087,ads_E:-0.175371 ratio:1.1,dipole:1.00519,distance:1.30734,ads_E:-5.4061
5 Cu54N ratio:0.96,dipole:0.160,distance:-0.035,ads_E:-4.570 ratio:1.36,dipole:-0.067,distance:4.254,ads_E:-0.030 ratio:1.1,dipole:1.088,distance:1.437,ads_E:-3.705
6 Cu54O ratio:0.960,dipole:0.131,distance:0.342,ads_E:-5.226 ratio:1.550,dipole:3.996,distance:6.765,ads_E:-0.507 ratio:1.100,dipole:1.502,distance:1.866,ads_E:-3.941
7 Cu54F ratio:0.960,dipole:0.260,distance:0.787,ads_E:-4.090 ratio:1.600,dipole:10.431,distance:8.031,ads_E:-0.769 ratio:1.100,dipole:3.086,distance:2.371,ads_E:-3.138
8 Cu54Ar ratio:0.94,dipole:-0.431,distance:2.731,ads_E:0.139 ratio:1.16,dipole:0.006,distance:5.716,ads_E:-0.008 ratio:1.02,dipole:-0.049,distance:3.817,ads_E:-0.015