ASE database

ID Formula Magnetic moment ads_site Mass Energy distance Volume Maximum force Number of atoms plane_index str_E
101 Au72Na -0.000 1b 14204.583 -220.823 2.409 3649.858 0.009 73 110 -220.823
102 Au72Mg 0.000 1b 14205.898 -220.273 1.938 3649.858 0.008 73 110 -220.273
103 AlAu72 -0.000 1b 14208.575 -222.069 1.701 3649.858 0.007 73 110 -222.069
104 Au72Si -0.000 1b 14209.678 -223.274 1.560 3649.858 0.006 73 110 -223.274
105 Au72P -0.003 1b 14212.567 -223.458 1.549 3649.858 0.009 73 110 -223.458
106 Au72S -0.000 1b 14213.653 -223.028 1.636 3649.858 0.007 73 110 -223.028
107 Au72Cl -0.000 1b 14217.043 -221.679 1.936 3649.858 0.009 73 110 -221.679
108 Au72Ar -0.000 1b 14221.541 -218.551 3.439 3649.858 0.007 73 110 -218.551
109 Au72H 0.000 0t 14182.601 -221.776 1.599 3649.858 0.006 73 110 -221.776
110 Au72He 0.000 0t 14185.596 -218.530 3.610 3649.858 0.008 73 110 -218.530
111 Au72Li -0.000 0t 14188.533 -221.011 2.237 3649.858 0.008 73 110 -221.011
112 Au72Be -0.004 0t 14190.605 -220.240 2.078 3649.858 0.006 73 110 -220.240
113 Au72B 0.000 0t 14192.403 -221.920 1.927 3649.858 0.005 73 110 -221.920
114 Au72C 0.001 0t 14193.604 -222.605 1.835 3649.858 0.006 73 110 -222.605
115 Au72N 0.000 0t 14195.600 -222.623 1.836 3649.858 0.008 73 110 -222.623
116 Au72O -0.000 0t 14197.592 -222.603 1.889 3649.858 0.008 73 110 -222.603
117 Au72F 0.000 0t 14200.591 -222.249 2.038 3649.858 0.007 73 110 -222.249
118 Au72Ne -0.000 0t 14201.773 -218.546 3.629 3649.858 0.009 73 110 -218.546
119 Au72Na -0.000 0t 14204.583 -220.649 2.544 3649.858 0.009 73 110 -220.649
120 Au72Mg 0.000 0t 14205.898 -219.792 2.384 3649.858 0.009 73 110 -219.792
121 AlAu72 0.000 0t 14208.575 -221.476 2.395 3649.858 0.010 73 110 -221.476
122 Au72Si -0.000 0t 14209.678 -222.175 2.136 3649.858 0.006 73 110 -222.175
123 Au72P 0.000 0t 14212.567 -222.119 2.139 3649.858 0.034 73 110 -222.119
124 Au72S -0.000 0t 14213.653 -221.946 2.212 3649.858 0.010 73 110 -221.946
125 Au72Cl -0.000 0t 14217.043 -221.439 2.331 3649.858 0.006 73 110 -221.439