ASE database

Displaying rows 1-25 out of 31
↓ ID ✕ Formula ✕ no_equ_23 ✕ no_equ_27 ✕ no_equ_16 ✕ Maximum stress ✕ no_equ_22 ✕ no_equ_5 ✕
1 Cu54Li - - ratio:1.9,dipole:-3.128,distance:12.609,ads_E:-0.058 0.009 - ratio:1.03,dipole:-2.924,distance:2.235,ads_E:-2.040
2 BeCu54 - - ratio:1.5,dipole:-0.0113499,distance:6.50408,ads_E:-0.00416696 0.008 - ratio:1.03,dipole:-0.173906,distance:1.30562,ads_E:-2.87935
3 Cu54B - - ratio:2.000,dipole:-1.008,distance:10.843,ads_E:-0.007 0.008 - ratio:1.030,dipole:0.635,distance:0.668,ads_E:-5.579
4 Cu54C - - ratio:1.51,dipole:2.9677,distance:5.57616,ads_E:-0.10513 0.008 - ratio:1.03,dipole:0.653681,distance:0.578516,ads_E:-6.33223
5 Cu54N - - ratio:1.45,dipole:0.007,distance:5.116,ads_E:-0.007 0.007 - ratio:1.03,dipole:0.566,distance:0.701,ads_E:-4.655
6 Cu54O - - ratio:2.100,dipole:4.187,distance:12.753,ads_E:-0.168 0.009 - ratio:1.030,dipole:0.754,distance:1.104,ads_E:-5.283
7 Cu54F - - - 0.009 - ratio:1.030,dipole:1.159,distance:1.579,ads_E:-4.212
8 Cu54Ar ratio:1.34,dipole:0.001,distance:8.158,ads_E:-0.005 ratio:1.42,dipole:0.000,distance:9.243,ads_E:-0.005 ratio:1.2,dipole:0.005,distance:6.259,ads_E:-0.006 0.009 ratio:1.32,dipole:0.002,distance:7.887,ads_E:-0.005 ratio:0.98,dipole:-0.177,distance:3.274,ads_E:0.014