ASE database

Displaying rows 1-25 out of 2180
no_equ_28 ✕ slab_E ✕ Magnetic moment ✕ no_equ_15 ✕ no_equ_27 ✕ Charge ✕ no_equ_17 ✕ no_equ_10 ✕ Maximum force ✕
- -190.592 0.000 ratio:1.7,dipole:-2.867,distance:10.224,ads_E:-0.066 - 0.000 - ratio:1.17,dipole:-3.222,distance:3.904,ads_E:-0.582 0.009
- -190.592 -0.000 ratio:1.45,dipole:-0.0224294,distance:5.95106,ads_E:-0.00714774 - 0.000 ratio:1.55,dipole:-0.00631543,distance:7.10066,ads_E:-0.00261613 ratio:1.2,dipole:-0.359907,distance:3.18592,ads_E:-0.372501 0.010
- -190.592 0.000 ratio:1.900,dipole:-0.558,distance:9.794,ads_E:-0.180 - 0.000 ratio:2.100,dipole:-0.833,distance:11.891,ads_E:-0.007 ratio:1.200,dipole:0.935,distance:2.451,ads_E:-2.045 0.005
- -190.592 -0.000 ratio:1.45,dipole:2.19263,distance:4.95146,ads_E:-0.182345 - 0.000 ratio:1.55,dipole:3.07149,distance:5.99264,ads_E:-0.095025 ratio:1.2,dipole:1.54212,distance:2.34852,ads_E:-2.29339 0.010
- -190.592 -0.000 ratio:1.4,dipole:-0.095,distance:4.680,ads_E:-0.016 - 0.000 ratio:1.5,dipole:0.030,distance:5.736,ads_E:-0.004 ratio:1.2,dipole:1.380,distance:2.488,ads_E:-0.433 0.005
- -190.592 0.000 ratio:1.900,dipole:6.642,distance:10.576,ads_E:-0.174 - 0.000 - ratio:1.200,dipole:3.021,distance:2.955,ads_E:-0.945 0.008
- -190.592 -0.000 ratio:1.900,dipole:13.468,distance:11.427,ads_E:-0.666 - 0.000 - ratio:1.250,dipole:6.761,distance:4.069,ads_E:-1.287 0.006
ratio:1.44,dipole:0.000,distance:9.515,ads_E:-0.005 -190.592 -0.000 ratio:1.18,dipole:0.006,distance:5.987,ads_E:-0.007 ratio:1.42,dipole:0.000,distance:9.243,ads_E:-0.005 0.000 ratio:1.22,dipole:0.004,distance:6.530,ads_E:-0.006 ratio:1.08,dipole:0.005,distance:4.631,ads_E:-0.014 0.007