ASE database

ID Formula Calculator E Energy Mass Volume
76 Au10Si4 vasp 0.237 -50.364 2082.006 1722.021
77 Au10Si4 vasp 0.236 -50.370 2082.006 1722.604
78 Au10Si4 vasp 0.236 -50.375 2082.006 1721.777
79 Au10Si4 vasp 0.236 -50.371 2082.006 1721.742
80 Au10Si4 vasp 0.236 -50.367 2082.006 1721.845
81 Au10Si4 vasp 0.237 -50.366 2082.006 1721.747
82 Au10Si4 vasp 0.236 -50.374 2082.006 1721.884
83 Au10Si4 vasp 0.236 -50.371 2082.006 1721.746
84 Au10Si4 vasp 0.237 -50.362 2082.006 1722.084
85 Au10Si4 vasp 0.237 -50.366 2082.006 1722.501
86 Au10Si4 vasp 0.236 -50.370 2082.006 1721.378
87 Au10Si4 vasp 0.236 -50.370 2082.006 1721.753
88 Au10Si4 vasp 0.237 -50.361 2082.006 1722.208
89 Au20Si8 vasp 0.233 -100.835 4164.011 3442.401
90 Au10Si6 vasp 0.303 -59.672 2138.176 1897.249
91 Au10Si6 vasp 0.303 -59.676 2138.176 1897.081
92 Au10Si6 vasp 0.303 -59.681 2138.176 1897.221
93 Au10Si6 vasp 0.303 -59.679 2138.176 1897.289
94 Au10Si6 vasp 0.303 -59.678 2138.176 1897.381
95 Au10Si6 vasp 0.303 -59.678 2138.176 1897.418
96 Au10Si6 vasp 0.303 -59.678 2138.176 1897.258
97 Au10Si6 vasp 0.303 -59.681 2138.176 1897.158
98 Au10Si6 vasp 0.303 -59.681 2138.176 1897.320
99 Au10Si6 vasp 0.303 -59.682 2138.176 1897.134
100 Au10Si6 vasp 0.303 -59.678 2138.176 1897.424