ASE database

Displaying rows 76-100 out of 594
↓ ID ✕ Energy ✕ Volume ✕ Calculator ✕ Mass ✕ distance ✕ PBC ✕ slab_E ✕ Maximum force ✕
76 -222.247 3649.858 vasp 17285.869 0.376 TTT -218.527 0.009
77 -224.037 3649.858 vasp 17285.869 0.004 TTT -218.527 0.006
78 -224.356 3649.858 vasp 17285.869 -0.057 TTT -218.527 0.007
79 -223.581 3649.858 vasp 17285.869 1.019 TTT -218.527 0.009
80 -223.229 3649.858 vasp 17285.869 1.128 TTT -218.527 0.010
81 -222.245 3649.858 vasp 17285.869 1.287 TTT -218.527 0.009
82 -218.548 3649.858 vasp 17285.869 3.219 TTT -218.527 0.007
83 -221.145 3649.858 vasp 17285.869 1.783 TTT -218.527 0.004
84 -220.986 3649.858 vasp 17285.869 1.048 TTT -218.527 0.005
85 -222.861 3649.858 vasp 17285.869 0.555 TTT -218.527 0.006
86 -223.955 3649.858 vasp 17285.869 0.496 TTT -218.527 0.009
87 -223.843 3649.858 vasp 17285.869 0.638 TTT -218.527 0.007
88 -222.907 3649.858 vasp 17285.869 1.456 TTT -218.527 0.009
89 -221.497 3649.858 vasp 17285.869 1.702 TTT -218.527 0.010
90 -218.552 3649.858 vasp 17285.869 3.199 TTT -218.527 0.006
91 -221.957 3649.858 vasp 17285.869 1.011 TTT -218.527 0.008
92 -218.530 3649.858 vasp 17285.869 3.531 TTT -218.527 0.009
93 -221.258 3649.858 vasp 17285.869 2.014 TTT -218.527 0.009
94 -221.998 3649.858 vasp 17285.869 0.794 TTT -218.527 0.006
95 -224.163 3649.858 vasp 17285.869 -1.286 TTT -218.527 0.007
96 -224.114 3649.858 vasp 17285.869 0.883 TTT -218.527 0.009
97 -223.914 3649.858 vasp 17285.869 1.085 TTT -218.527 0.010
98 -223.523 3649.858 vasp 17285.869 1.199 TTT -218.527 0.010
99 -222.402 3649.858 vasp 17285.869 1.545 TTT -218.527 0.009
100 -218.547 3649.858 vasp 17285.869 3.558 TTT -218.527 0.007