ASE database

Displaying rows 1-8 out of 8
↓ ID ✕ Formula ✕ no_equ_1 ✕ no_equ_25 ✕ no_equ_17 ✕ no_equ_4 ✕ no_equ_29 ✕
1 Cu54Li ratio:0.9,dipole:-0.645,distance:0.684,ads_E:-1.046 - - ratio:1,dipole:-2.353,distance:1.877,ads_E:-2.141 -
2 BeCu54 ratio:0.9,dipole:0.302883,distance:-0.132247,ads_E:-2.36046 - ratio:1.55,dipole:-0.00631543,distance:7.10066,ads_E:-0.00261613 ratio:1,dipole:0.00345513,distance:0.973808,ads_E:-2.95616 -
3 Cu54B ratio:0.900,dipole:-0.012,distance:-0.696,ads_E:-4.781 - ratio:2.100,dipole:-0.833,distance:11.891,ads_E:-0.007 ratio:1.000,dipole:0.557,distance:0.353,ads_E:-5.662 -
4 Cu54C ratio:0.9,dipole:-0.0331232,distance:-0.775014,ads_E:-5.11493 - ratio:1.55,dipole:3.07149,distance:5.99264,ads_E:-0.095025 ratio:1,dipole:0.52283,distance:0.266163,ads_E:-6.42427 -
5 Cu54N ratio:0.9,dipole:-0.149,distance:-0.666,ads_E:-3.448 - ratio:1.5,dipole:0.030,distance:5.736,ads_E:-0.004 ratio:1,dipole:0.368,distance:0.386,ads_E:-4.725 -
6 Cu54O ratio:0.900,dipole:-0.175,distance:-0.311,ads_E:-4.372 - - ratio:1.000,dipole:0.486,distance:0.778,ads_E:-5.406 -
7 Cu54F ratio:0.900,dipole:-0.137,distance:0.107,ads_E:-3.084 - - ratio:1.000,dipole:0.693,distance:1.239,ads_E:-4.335 -
8 Cu54Ar ratio:0.9,dipole:-0.757,distance:2.324,ads_E:0.500 ratio:1.38,dipole:0.000,distance:8.701,ads_E:-0.005 ratio:1.22,dipole:0.004,distance:6.530,ads_E:-0.006 ratio:0.96,dipole:-0.291,distance:3.002,ads_E:0.057 ratio:1.46,dipole:0.000,distance:9.786,ads_E:-0.005