ASE database

ID Formula Age Volume Username Dipole_val ads_E
101 Au72Na 15M 3649.858 hecc -6.067 -2.072
102 Au72Mg 15M 3649.858 hecc -3.492 -1.742
103 AlAu72 15M 3649.858 hecc -1.522 -3.248
104 Au72Si 15M 3649.858 hecc -0.561 -3.917
105 Au72P 15M 3649.858 hecc 0.405 -3.043
106 Au72S 15M 3649.858 hecc 1.306 -3.556
107 Au72Cl 15M 3649.858 hecc 1.286 -2.909
108 Au72Ar 15M 3649.858 hecc -0.163 0.002
109 Au72H 15M 3649.858 hecc 0.312 -2.132
110 Au72He 15M 3649.858 hecc -0.024 -0.005
111 Au72Li 15M 3649.858 hecc -5.675 -2.185
112 Au72Be 15M 3649.858 hecc -1.886 -1.673
113 Au72B 15M 3649.858 hecc 0.023 -3.045
114 Au72C 15M 3649.858 hecc 0.775 -2.830
115 Au72N 15M 3649.858 hecc 1.821 -0.972
116 Au72O 15M 3649.858 hecc 2.735 -2.543
117 Au72F 15M 3649.858 hecc 2.894 -3.298
118 Au72Ne 15M 3649.858 hecc -0.020 -0.007
119 Au72Na 15M 3649.858 hecc -6.877 -1.897
120 Au72Mg 15M 3649.858 hecc -3.881 -1.261
121 AlAu72 15M 3649.858 hecc -2.381 -2.655
122 Au72Si 15M 3649.858 hecc -1.395 -2.818
123 Au72P 15M 3649.858 hecc 0.382 -1.704
124 Au72S 15M 3649.858 hecc 2.053 -2.475
125 Au72Cl 15M 3649.858 hecc 2.575 -2.669