ASE database

ID Formula Number of atoms Charge slab_E Username str_E Age
101 Au72Na 73 0.000 -218.527 hecc -220.823 15M
102 Au72Mg 73 0.000 -218.527 hecc -220.273 15M
103 AlAu72 73 0.000 -218.527 hecc -222.069 15M
104 Au72Si 73 0.000 -218.527 hecc -223.274 15M
105 Au72P 73 0.000 -218.527 hecc -223.458 15M
106 Au72S 73 0.000 -218.527 hecc -223.028 15M
107 Au72Cl 73 0.000 -218.527 hecc -221.679 15M
108 Au72Ar 73 0.000 -218.527 hecc -218.551 15M
109 Au72H 73 0.000 -218.527 hecc -221.776 15M
110 Au72He 73 0.000 -218.527 hecc -218.530 15M
111 Au72Li 73 0.000 -218.527 hecc -221.011 15M
112 Au72Be 73 0.000 -218.527 hecc -220.240 15M
113 Au72B 73 0.000 -218.527 hecc -221.920 15M
114 Au72C 73 0.000 -218.527 hecc -222.605 15M
115 Au72N 73 0.000 -218.527 hecc -222.623 15M
116 Au72O 73 0.000 -218.527 hecc -222.603 15M
117 Au72F 73 0.000 -218.527 hecc -222.249 15M
118 Au72Ne 73 0.000 -218.527 hecc -218.546 15M
119 Au72Na 73 0.000 -218.527 hecc -220.649 15M
120 Au72Mg 73 0.000 -218.527 hecc -219.792 15M
121 AlAu72 73 0.000 -218.527 hecc -221.476 15M
122 Au72Si 73 0.000 -218.527 hecc -222.175 15M
123 Au72P 73 0.000 -218.527 hecc -222.119 15M
124 Au72S 73 0.000 -218.527 hecc -221.946 15M
125 Au72Cl 73 0.000 -218.527 hecc -221.439 15M