ASE database

Displaying rows 1-8 out of 8
↓ ID ✕ Formula ✕ no_equ_4 ✕ no_equ_17 ✕ no_equ_18 ✕ no_equ_13 ✕ no_equ_9 ✕ no_equ_16 ✕
1 Cu54Li ratio:1,dipole:-2.353,distance:1.877,ads_E:-2.141 - - ratio:1.35,dipole:-2.533,distance:6.051,ads_E:-0.126 ratio:1.15,dipole:-3.511,distance:3.666,ads_E:-0.744 ratio:1.9,dipole:-3.128,distance:12.609,ads_E:-0.058
2 BeCu54 ratio:1,dipole:0.00345513,distance:0.973808,ads_E:-2.95616 ratio:1.55,dipole:-0.00631543,distance:7.10066,ads_E:-0.00261613 ratio:1.6,dipole:-0.00466727,distance:7.61014,ads_E:-0.0017761 ratio:1.35,dipole:-0.0991408,distance:4.845,ads_E:-0.0276465 ratio:1.16,dipole:-0.39644,distance:2.7435,ads_E:-0.772653 ratio:1.5,dipole:-0.0113499,distance:6.50408,ads_E:-0.00416696
3 Cu54B ratio:1.000,dipole:0.557,distance:0.353,ads_E:-5.662 ratio:2.100,dipole:-0.833,distance:11.891,ads_E:-0.007 - ratio:1.400,dipole:-0.694,distance:4.626,ads_E:-0.236 ratio:1.160,dipole:0.981,distance:2.032,ads_E:-3.278 ratio:2.000,dipole:-1.008,distance:10.843,ads_E:-0.007
4 Cu54C ratio:1,dipole:0.52283,distance:0.266163,ads_E:-6.42427 ratio:1.55,dipole:3.07149,distance:5.99264,ads_E:-0.095025 ratio:1.6,dipole:3.20521,distance:6.61329,ads_E:-0.0862335 ratio:1.35,dipole:2.50975,distance:3.91028,ads_E:-0.271632 ratio:1.16,dipole:1.37647,distance:1.93205,ads_E:-3.75037 ratio:1.51,dipole:2.9677,distance:5.57616,ads_E:-0.10513
5 Cu54N ratio:1,dipole:0.368,distance:0.386,ads_E:-4.725 ratio:1.5,dipole:0.030,distance:5.736,ads_E:-0.004 ratio:1.55,dipole:0.009,distance:6.168,ads_E:-0.002 ratio:1.33,dipole:0.416,distance:3.855,ads_E:-0.042 ratio:1.16,dipole:1.554,distance:2.068,ads_E:-1.933 ratio:1.45,dipole:0.007,distance:5.116,ads_E:-0.007
6 Cu54O ratio:1.000,dipole:0.486,distance:0.778,ads_E:-5.406 - - ratio:1.350,dipole:3.982,distance:4.588,ads_E:-0.321 ratio:1.160,dipole:2.453,distance:2.519,ads_E:-1.842 ratio:2.100,dipole:4.187,distance:12.753,ads_E:-0.168
7 Cu54F ratio:1.000,dipole:0.693,distance:1.239,ads_E:-4.335 - - ratio:1.550,dipole:9.933,distance:7.465,ads_E:-0.801 ratio:1.160,dipole:5.403,distance:3.050,ads_E:-2.006 -
8 Cu54Ar ratio:0.96,dipole:-0.291,distance:3.002,ads_E:0.057 ratio:1.22,dipole:0.004,distance:6.530,ads_E:-0.006 ratio:1.24,dipole:0.002,distance:6.801,ads_E:-0.005 ratio:1.14,dipole:0.008,distance:5.445,ads_E:-0.009 ratio:1.06,dipole:-0.003,distance:4.359,ads_E:-0.016 ratio:1.2,dipole:0.005,distance:6.259,ads_E:-0.006