ASE database

Displaying rows 126-31 out of 31
↓ ID ✕ Formula ✕ ads_site ✕ str_E ✕ slab_E ✕ Dipole_val ✕
126 Au72Ar 0t -218.555 -218.527 -0.163
127 Au45H 2h -141.912 -138.685 -0.104
128 Au45He 2h -138.731 -138.685 -0.016
129 Au45Li 2h -141.636 -138.685 -3.630
130 Au45Be 2h -141.723 -138.685 -1.015
131 Au45B 2h -143.780 -138.685 -0.111
132 Au45C 2h -144.527 -138.685 -0.020
133 Au45N 2h -144.187 -138.685 0.338
134 Au45O 2h -143.540 -138.685 0.650
135 Au45F 2h -142.249 -138.685 1.205
136 Au45Ne 2h -138.747 -138.685 -0.009
137 Au45Na 2h -141.146 -138.685 -5.167
138 Au45Mg 2h -140.579 -138.685 -3.300
139 AlAu45 2h -142.301 -138.685 -1.354
140 Au45Si 2h -143.667 -138.685 -0.515
141 Au45P 2h -143.967 -138.685 -0.046
142 Au45S 2h -143.196 -138.685 0.293
143 Au45Cl 2h -141.422 -138.685 0.783
144 Au45Ar 2h -138.753 -138.685 -0.073
145 Au45H 3h -141.936 -138.685 -0.109
146 Au45He 3h -138.730 -138.685 -0.017
147 Au45Li 3h -141.640 -138.685 -3.625
148 Au45Be 3h -141.741 -138.685 -1.007
149 Au45B 3h -143.821 -138.685 -0.087
150 Au45C 3h -144.626 -138.685 0.084