ASE database

Displaying rows 176-8 out of 8
↓ ID ✕ Formula ✕ Username ✕ slab_E ✕ ads_site ✕ Dipole_val ✕
176 Au45Si hecc -138.685 1b -0.472
177 Au45P hecc -138.685 1b -0.038
178 Au45S hecc -138.685 1b 0.251
179 Au45Cl hecc -138.685 1b 0.557
180 Au45Ar hecc -138.685 1b -0.084
181 Au45H hecc -138.685 0t 0.000
182 Au45He hecc -138.685 0t -0.020
183 Au45Li hecc -138.685 0t -4.589
184 Au45Be hecc -138.685 0t -1.616
185 Au45B hecc -138.685 0t -0.077
186 Au45C hecc -138.685 0t 0.556
187 Au45N hecc -138.685 0t 1.369
188 Au45O hecc -138.685 0t 2.145
189 Au45F hecc -138.685 0t 2.358
190 Au45Ne hecc -138.685 0t -0.014
191 Au45Na hecc -138.685 0t -5.688
192 Au45Mg hecc -138.685 0t -3.278
193 AlAu45 hecc -138.685 0t -1.925
194 Au45Si hecc -138.685 0t -1.123
195 Au45P hecc -138.685 0t -0.007
196 Au45S hecc -138.685 0t 1.375
197 Au45Cl hecc -138.685 0t 1.942
198 Au45Ar hecc -138.685 0t -0.093
199 Ag54H hecc -138.956 2f -0.074
200 Ag54He hecc -138.956 2f -0.020