ASE database

Displaying rows 1-25 out of 46
Username ✕ absorped_atom ✕ Maximum force ✕ Volume ✕ Mass ✕ index ✕
hecc N 0.391 1271.601 17285.869 (100)
hecc N 0.309 1271.601 17285.869 (100)
hecc N 0.369 1271.601 17285.869 (100)
hecc F 0.398 1271.601 17285.869 (100)
hecc F 0.336 1271.601 17285.869 (100)
hecc F 0.393 1271.601 17285.869 (100)
hecc O 0.409 1271.601 17285.869 (100)
hecc O 0.320 1271.601 17285.869 (100)
hecc O 0.385 1271.601 17285.869 (100)
hecc B 0.383 1271.601 17285.869 (100)
hecc B 0.331 1271.601 17285.869 (100)
hecc B 0.383 1271.601 17285.869 (100)
hecc C 0.373 1271.601 17285.869 (100)
hecc C 0.314 1271.601 17285.869 (100)
hecc C 0.372 1271.601 17285.869 (100)
hecc N 0.616 1599.670 17285.869 (110)
hecc N 0.490 1599.670 17285.869 (110)
hecc N 0.530 1599.670 17285.869 (110)
hecc N 0.617 1599.670 17285.869 (110)
hecc F 0.576 1599.670 17285.869 (110)
hecc F 0.496 1599.670 17285.869 (110)
hecc F 0.505 1599.670 17285.869 (110)
hecc F 0.490 1599.670 17285.869 (110)
hecc O 0.595 1599.670 17285.869 (110)
hecc O 0.499 1599.670 17285.869 (110)