ASE database

Displaying rows 101-8 out of 8
↓ ID ✕ Formula ✕ Energy ✕ str_E ✕ Maximum force ✕ slab_E ✕
101 Au72Na -220.823 -220.823 0.009 -218.527
102 Au72Mg -220.273 -220.273 0.008 -218.527
103 AlAu72 -222.069 -222.069 0.007 -218.527
104 Au72Si -223.274 -223.274 0.006 -218.527
105 Au72P -223.458 -223.458 0.009 -218.527
106 Au72S -223.028 -223.028 0.007 -218.527
107 Au72Cl -221.679 -221.679 0.009 -218.527
108 Au72Ar -218.551 -218.551 0.007 -218.527
109 Au72H -221.776 -221.776 0.006 -218.527
110 Au72He -218.530 -218.530 0.008 -218.527
111 Au72Li -221.011 -221.011 0.008 -218.527
112 Au72Be -220.240 -220.240 0.006 -218.527
113 Au72B -221.920 -221.920 0.005 -218.527
114 Au72C -222.605 -222.605 0.006 -218.527
115 Au72N -222.623 -222.623 0.008 -218.527
116 Au72O -222.603 -222.603 0.008 -218.527
117 Au72F -222.249 -222.249 0.007 -218.527
118 Au72Ne -218.546 -218.546 0.009 -218.527
119 Au72Na -220.649 -220.649 0.009 -218.527
120 Au72Mg -219.792 -219.792 0.009 -218.527
121 AlAu72 -221.476 -221.476 0.010 -218.527
122 Au72Si -222.175 -222.175 0.006 -218.527
123 Au72P -222.119 -222.119 0.034 -218.527
124 Au72S -221.946 -221.946 0.010 -218.527
125 Au72Cl -221.439 -221.439 0.006 -218.527