ASE database

ID Formula str_E Maximum force slab_E Volume
126 Au72Ar -218.555 0.010 -218.527 3649.858
127 Au45H -141.912 0.009 -138.685 2322.637
128 Au45He -138.731 0.009 -138.685 2322.637
129 Au45Li -141.636 0.007 -138.685 2322.637
130 Au45Be -141.723 0.007 -138.685 2322.637
131 Au45B -143.780 0.009 -138.685 2322.637
132 Au45C -144.527 0.009 -138.685 2322.637
133 Au45N -144.187 0.006 -138.685 2322.637
134 Au45O -143.540 0.010 -138.685 2322.637
135 Au45F -142.249 0.010 -138.685 2322.637
136 Au45Ne -138.747 0.009 -138.685 2322.637
137 Au45Na -141.146 0.009 -138.685 2322.637
138 Au45Mg -140.579 0.004 -138.685 2322.637
139 AlAu45 -142.301 0.010 -138.685 2322.637
140 Au45Si -143.667 0.007 -138.685 2322.637
141 Au45P -143.967 0.011 -138.685 2322.637
142 Au45S -143.196 0.008 -138.685 2322.637
143 Au45Cl -141.422 0.006 -138.685 2322.637
144 Au45Ar -138.753 0.009 -138.685 2322.637
145 Au45H -141.936 0.005 -138.685 2322.637
146 Au45He -138.730 0.010 -138.685 2322.637
147 Au45Li -141.640 0.008 -138.685 2322.637
148 Au45Be -141.741 0.007 -138.685 2322.637
149 Au45B -143.821 0.005 -138.685 2322.637
150 Au45C -144.626 0.007 -138.685 2322.637