ASE database

Displaying rows 101-125 out of 594
↓ ID ✕ Formula ✕ Username ✕ Maximum stress ✕ Maximum force ✕ PBC ✕ distance ✕ str_E ✕ Charge ✕ Mass ✕
101 Au72Na hecc 0.014 0.009 TTT 2.409 -220.823 0.000 14204.583
102 Au72Mg hecc 0.012 0.008 TTT 1.938 -220.273 0.000 14205.898
103 AlAu72 hecc 0.012 0.007 TTT 1.701 -222.069 0.000 14208.575
104 Au72Si hecc 0.012 0.006 TTT 1.560 -223.274 0.000 14209.678
105 Au72P hecc 0.013 0.009 TTT 1.549 -223.458 0.000 14212.567
106 Au72S hecc 0.013 0.007 TTT 1.636 -223.028 0.000 14213.653
107 Au72Cl hecc 0.013 0.009 TTT 1.936 -221.679 0.000 14217.043
108 Au72Ar hecc 0.013 0.007 TTT 3.439 -218.551 0.000 14221.541
109 Au72H hecc 0.013 0.006 TTT 1.599 -221.776 0.000 14182.601
110 Au72He hecc 0.013 0.008 TTT 3.610 -218.530 0.000 14185.596
111 Au72Li hecc 0.014 0.008 TTT 2.237 -221.011 0.000 14188.533
112 Au72Be hecc 0.013 0.006 TTT 2.078 -220.240 0.000 14190.605
113 Au72B hecc 0.013 0.005 TTT 1.927 -221.920 0.000 14192.403
114 Au72C hecc 0.013 0.006 TTT 1.835 -222.605 0.000 14193.604
115 Au72N hecc 0.013 0.008 TTT 1.836 -222.623 0.000 14195.600
116 Au72O hecc 0.013 0.008 TTT 1.889 -222.603 0.000 14197.592
117 Au72F hecc 0.012 0.007 TTT 2.038 -222.249 0.000 14200.591
118 Au72Ne hecc 0.013 0.009 TTT 3.629 -218.546 0.000 14201.773
119 Au72Na hecc 0.014 0.009 TTT 2.544 -220.649 0.000 14204.583
120 Au72Mg hecc 0.013 0.009 TTT 2.384 -219.792 0.000 14205.898
121 AlAu72 hecc 0.014 0.010 TTT 2.395 -221.476 0.000 14208.575
122 Au72Si hecc 0.014 0.006 TTT 2.136 -222.175 0.000 14209.678
123 Au72P hecc 0.013 0.034 TTT 2.139 -222.119 0.000 14212.567
124 Au72S hecc 0.013 0.010 TTT 2.212 -221.946 0.000 14213.653
125 Au72Cl hecc 0.012 0.006 TTT 2.331 -221.439 0.000 14217.043