ASE database

Displaying rows 1-8 out of 8
Formula ✕ no_equ_18 ✕ no_equ_8 ✕ no_equ_12 ✕ no_equ_1 ✕
Cu54Li - ratio:1.13,dipole:-3.714,distance:3.427,ads_E:-0.940 ratio:1.3,dipole:-2.555,distance:5.454,ads_E:-0.165 ratio:0.9,dipole:-0.645,distance:0.684,ads_E:-1.046
BeCu54 ratio:1.6,dipole:-0.00466727,distance:7.61014,ads_E:-0.0017761 ratio:1.13,dipole:-0.472991,distance:2.41168,ads_E:-1.3327 ratio:1.3,dipole:-0.18803,distance:4.29197,ads_E:-0.0630632 ratio:0.9,dipole:0.302883,distance:-0.132247,ads_E:-2.36046
Cu54B - ratio:1.130,dipole:0.870,distance:1.717,ads_E:-4.122 ratio:1.350,dipole:-0.748,distance:4.025,ads_E:-0.303 ratio:0.900,dipole:-0.012,distance:-0.696,ads_E:-4.781
Cu54C ratio:1.6,dipole:3.20521,distance:6.61329,ads_E:-0.0862335 ratio:1.13,dipole:1.19768,distance:1.61969,ads_E:-4.67472 ratio:1.3,dipole:2.30687,distance:3.38969,ads_E:-0.486531 ratio:0.9,dipole:-0.0331232,distance:-0.775014,ads_E:-5.11493
Cu54N ratio:1.55,dipole:0.009,distance:6.168,ads_E:-0.002 ratio:1.13,dipole:1.347,distance:1.752,ads_E:-2.917 ratio:1.3,dipole:0.575,distance:3.539,ads_E:-0.068 ratio:0.9,dipole:-0.149,distance:-0.666,ads_E:-3.448
Cu54O - ratio:1.130,dipole:1.922,distance:2.193,ads_E:-2.973 ratio:1.310,dipole:3.768,distance:4.152,ads_E:-0.372 ratio:0.900,dipole:-0.175,distance:-0.311,ads_E:-4.372
Cu54F - ratio:1.130,dipole:4.250,distance:2.711,ads_E:-2.537 ratio:1.450,dipole:8.949,distance:6.333,ads_E:-0.889 ratio:0.900,dipole:-0.137,distance:0.107,ads_E:-3.084
Cu54Ar ratio:1.24,dipole:0.002,distance:6.801,ads_E:-0.005 ratio:1.04,dipole:-0.018,distance:4.088,ads_E:-0.017 ratio:1.12,dipole:0.009,distance:5.173,ads_E:-0.010 ratio:0.9,dipole:-0.757,distance:2.324,ads_E:0.500