ASE database

Displaying rows 301-325 out of 414
Formula ✕ Maximum force ✕ perms_num ✕ PBC ✕ Number of atoms ✕ Energy ✕ Maximum stress ✕ Calculator ✕ Charge ✕ Mass ✕ Age ✕ Volume ✕
C60H24 0.010 6 TTT 84 -620.300 0.000 vasp 0.000 744.852 6y 8000.000
C60H24 0.014 6 TTT 84 -616.974 0.000 vasp 0.000 744.852 6y 8000.000
C60H24 0.016 6 TTT 84 -616.822 0.000 vasp 0.000 744.852 6y 8000.000
C60H24 0.008 6 TTT 84 -620.116 0.000 vasp 0.000 744.852 6y 8000.000
C60H24 0.010 6 TTT 84 -620.222 0.000 vasp 0.000 744.852 6y 8000.000
C60H24 0.016 6 TTT 84 -618.939 0.000 vasp 0.000 744.852 6y 8000.000
C60H24 0.014 6 TTT 84 -618.140 0.000 vasp 0.000 744.852 6y 8000.000
C60H24 0.007 12 TTT 84 -622.094 0.000 vasp 0.000 744.852 6y 8000.000
C60H24 0.037 6 TTT 84 -618.285 0.000 vasp 0.000 744.852 6y 8000.000
C60H24 0.018 6 TTT 84 -615.294 0.000 vasp 0.000 744.852 6y 8000.000
C60H24 0.014 6 TTT 84 -621.156 0.000 vasp 0.000 744.852 6y 8000.000
C60H24 0.020 6 TTT 84 -621.246 0.000 vasp 0.000 744.852 6y 8000.000
C60H24 0.010 6 TTT 84 -620.434 0.000 vasp 0.000 744.852 6y 8000.000
C60H24 0.007 6 TTT 84 -620.415 0.000 vasp 0.000 744.852 6y 8000.000
C60H24 0.020 6 TTT 84 -611.337 0.000 vasp 0.000 744.852 6y 8000.000
C60H24 0.304 1 TTT 84 -611.446 0.000 vasp 0.000 744.852 6y 8000.000
C60H24 0.453 1 TTT 84 -610.168 0.001 vasp 0.000 744.852 6y 8000.000
C60H24 0.010 6 TTT 84 -608.109 0.000 vasp 0.000 744.852 6y 8000.000
C60H24 0.038 6 TTT 84 -619.812 0.000 vasp 0.000 744.852 6y 8000.000
C60H24 0.007 6 TTT 84 -615.170 0.000 vasp 0.000 744.852 6y 8000.000
C60H24 0.023 6 TTT 84 -618.652 0.000 vasp 0.000 744.852 6y 8000.000
C60H24 0.022 6 TTT 84 -619.698 0.000 vasp 0.000 744.852 6y 8000.000
C60H24 0.036 6 TTT 84 -614.490 0.000 vasp 0.000 744.852 6y 8000.000
C60H24 0.013 6 TTT 84 -611.039 0.000 vasp 0.000 744.852 6y 8000.000
C60H24 0.010 6 TTT 84 -619.927 0.000 vasp 0.000 744.852 6y 8000.000