ASE database

Displaying rows 101-125 out of 594
↓ ID ✕ Formula ✕ Magnetic moment ✕ Username ✕ Maximum force ✕ plane_index ✕ Age ✕ Maximum stress ✕ ads_site ✕ Calculator ✕ Charge ✕ distance ✕
101 Au72Na -0.000 hecc 0.009 110 15M 0.014 1b vasp 0.000 2.409
102 Au72Mg 0.000 hecc 0.008 110 15M 0.012 1b vasp 0.000 1.938
103 AlAu72 -0.000 hecc 0.007 110 15M 0.012 1b vasp 0.000 1.701
104 Au72Si -0.000 hecc 0.006 110 15M 0.012 1b vasp 0.000 1.560
105 Au72P -0.003 hecc 0.009 110 15M 0.013 1b vasp 0.000 1.549
106 Au72S -0.000 hecc 0.007 110 15M 0.013 1b vasp 0.000 1.636
107 Au72Cl -0.000 hecc 0.009 110 15M 0.013 1b vasp 0.000 1.936
108 Au72Ar -0.000 hecc 0.007 110 15M 0.013 1b vasp 0.000 3.439
109 Au72H 0.000 hecc 0.006 110 15M 0.013 0t vasp 0.000 1.599
110 Au72He 0.000 hecc 0.008 110 15M 0.013 0t vasp 0.000 3.610
111 Au72Li -0.000 hecc 0.008 110 15M 0.014 0t vasp 0.000 2.237
112 Au72Be -0.004 hecc 0.006 110 15M 0.013 0t vasp 0.000 2.078
113 Au72B 0.000 hecc 0.005 110 15M 0.013 0t vasp 0.000 1.927
114 Au72C 0.001 hecc 0.006 110 15M 0.013 0t vasp 0.000 1.835
115 Au72N 0.000 hecc 0.008 110 15M 0.013 0t vasp 0.000 1.836
116 Au72O -0.000 hecc 0.008 110 15M 0.013 0t vasp 0.000 1.889
117 Au72F 0.000 hecc 0.007 110 15M 0.012 0t vasp 0.000 2.038
118 Au72Ne -0.000 hecc 0.009 110 15M 0.013 0t vasp 0.000 3.629
119 Au72Na -0.000 hecc 0.009 110 15M 0.014 0t vasp 0.000 2.544
120 Au72Mg 0.000 hecc 0.009 110 15M 0.013 0t vasp 0.000 2.384
121 AlAu72 0.000 hecc 0.010 110 15M 0.014 0t vasp 0.000 2.395
122 Au72Si -0.000 hecc 0.006 110 15M 0.014 0t vasp 0.000 2.136
123 Au72P 0.000 hecc 0.034 110 15M 0.013 0t vasp 0.000 2.139
124 Au72S -0.000 hecc 0.010 110 15M 0.013 0t vasp 0.000 2.212
125 Au72Cl -0.000 hecc 0.006 110 15M 0.012 0t vasp 0.000 2.331