ASE database

ID Formula str_E Maximum force slab_E Volume
101 Au72Na -220.823 0.009 -218.527 3649.858
102 Au72Mg -220.273 0.008 -218.527 3649.858
103 AlAu72 -222.069 0.007 -218.527 3649.858
104 Au72Si -223.274 0.006 -218.527 3649.858
105 Au72P -223.458 0.009 -218.527 3649.858
106 Au72S -223.028 0.007 -218.527 3649.858
107 Au72Cl -221.679 0.009 -218.527 3649.858
108 Au72Ar -218.551 0.007 -218.527 3649.858
109 Au72H -221.776 0.006 -218.527 3649.858
110 Au72He -218.530 0.008 -218.527 3649.858
111 Au72Li -221.011 0.008 -218.527 3649.858
112 Au72Be -220.240 0.006 -218.527 3649.858
113 Au72B -221.920 0.005 -218.527 3649.858
114 Au72C -222.605 0.006 -218.527 3649.858
115 Au72N -222.623 0.008 -218.527 3649.858
116 Au72O -222.603 0.008 -218.527 3649.858
117 Au72F -222.249 0.007 -218.527 3649.858
118 Au72Ne -218.546 0.009 -218.527 3649.858
119 Au72Na -220.649 0.009 -218.527 3649.858
120 Au72Mg -219.792 0.009 -218.527 3649.858
121 AlAu72 -221.476 0.010 -218.527 3649.858
122 Au72Si -222.175 0.006 -218.527 3649.858
123 Au72P -222.119 0.034 -218.527 3649.858
124 Au72S -221.946 0.010 -218.527 3649.858
125 Au72Cl -221.439 0.006 -218.527 3649.858