ASE database

Displaying rows 51-31 out of 31
atom_E ✕ distance ✕ Energy ✕ Dipole_val ✕ ads_E ✕ Volume ✕ plane_index ✕ PBC ✕ Mass ✕ Username ✕ Magnetic moment ✕ Age ✕ ads_site ✕ Maximum stress ✕
-1.888 2.068 -168.614 0.133 -1.663 2654.442 100 TTT 17285.869 hecc -0.002 13M 0t 0.011
-0.945 2.223 -168.287 1.591 -2.279 2654.442 100 TTT 17285.869 hecc -0.000 13M 0t 0.011
-0.243 2.348 -167.708 2.287 -2.402 2654.442 100 TTT 17285.869 hecc -0.000 13M 0t 0.010
-0.025 3.732 -165.092 -0.102 -0.003 2654.442 100 TTT 17285.869 hecc 0.000 13M 0t 0.011
-1.117 0.550 -221.327 -0.181 -1.683 3649.858 110 TTT 17285.869 hecc 0.000 13M 2f 0.013
0.002 3.257 -218.530 -0.016 -0.005 3649.858 110 TTT 17285.869 hecc 0.000 13M 2f 0.013
-0.299 1.239 -221.779 -1.996 -2.954 3649.858 110 TTT 17285.869 hecc -0.000 13M 2f 0.014
-0.039 0.506 -222.351 -0.158 -3.785 3649.858 110 TTT 17285.869 hecc 0.000 13M 2f 0.014
-0.349 0.212 -223.965 0.170 -5.089 3649.858 110 TTT 17285.869 hecc 0.000 13M 2f 0.014
-1.248 0.153 -224.158 0.284 -4.383 3649.858 110 TTT 17285.869 hecc -0.000 13M 2f 0.013
-3.124 0.283 -223.660 0.438 -2.009 3649.858 110 TTT 17285.869 hecc 0.000 13M 2f 0.013
-1.533 0.490 -223.013 0.578 -2.954 3649.858 110 TTT 17285.869 hecc -0.000 13M 2f 0.013
-0.424 1.058 -221.958 1.101 -3.008 3649.858 110 TTT 17285.869 hecc -0.000 13M 2f 0.013
-0.013 3.091 -218.548 -0.007 -0.008 3649.858 110 TTT 17285.869 hecc 0.000 13M 2f 0.013
-0.225 1.723 -221.255 -3.683 -2.503 3649.858 110 TTT 17285.869 hecc 0.000 13M 2f 0.014
-0.004 1.112 -221.237 -1.984 -2.706 3649.858 110 TTT 17285.869 hecc -0.000 13M 2f 0.014
-0.295 0.784 -223.165 -0.572 -4.343 3649.858 110 TTT 17285.869 hecc -0.000 13M 2f 0.013
-0.830 0.676 -224.334 -0.022 -4.977 3649.858 110 TTT 17285.869 hecc 0.000 13M 2f 0.013
-1.888 0.689 -224.246 0.189 -3.831 3649.858 110 TTT 17285.869 hecc -0.000 13M 2f 0.013
-0.945 0.863 -222.981 0.303 -3.509 3649.858 110 TTT 17285.869 hecc 0.000 13M 2f 0.013
-0.243 1.609 -221.174 1.191 -2.405 3649.858 110 TTT 17285.869 hecc 0.000 13M 2f 0.013
-0.025 3.253 -218.555 -0.072 -0.002 3649.858 110 TTT 17285.869 hecc 0.000 13M 2f 0.013
-1.117 0.625 -221.601 -0.028 -1.957 3649.858 110 TTT 17285.869 hecc 0.000 13M 3b 0.013
0.002 3.259 -218.530 -0.021 -0.005 3649.858 110 TTT 17285.869 hecc -0.000 13M 3b 0.013
-0.299 1.284 -221.672 -2.222 -2.846 3649.858 110 TTT 17285.869 hecc 0.000 13M 3b 0.014