ASE database

Displaying rows 151-8 out of 8
↓ ID ✕ Formula ✕ Maximum force ✕ Dipole_val ✕ ads_site ✕ PBC ✕ Magnetic moment ✕ Maximum stress ✕ Volume ✕ Username ✕
151 Au45N 0.008 0.382 3h TTT -0.000 0.012 2322.637 hecc
152 Au45O 0.005 0.617 3h TTT -0.000 0.011 2322.637 hecc
153 Au45F 0.009 0.954 3h TTT 0.000 0.012 2322.637 hecc
154 Au45Ne 0.009 -0.010 3h TTT 0.000 0.015 2322.637 hecc
155 Au45Na 0.004 -5.173 3h TTT -0.000 0.015 2322.637 hecc
156 Au45Mg 0.007 -3.297 3h TTT 0.000 0.014 2322.637 hecc
157 AlAu45 0.007 -1.309 3h TTT 0.000 0.013 2322.637 hecc
158 Au45Si 0.005 -0.472 3h TTT 0.000 0.013 2322.637 hecc
159 Au45P 0.009 -0.036 3h TTT 0.000 0.012 2322.637 hecc
160 Au45S 0.009 0.254 3h TTT -0.000 0.011 2322.637 hecc
161 Au45Cl 0.006 0.554 3h TTT 0.000 0.012 2322.637 hecc
162 Au45Ar 0.006 -0.097 3h TTT 0.000 0.015 2322.637 hecc
163 Au45H 0.010 -0.072 1b TTT 0.000 0.014 2322.637 hecc
164 Au45He 0.010 -0.019 1b TTT -0.000 0.015 2322.637 hecc
165 Au45Li 0.009 -3.620 1b TTT 0.000 0.015 2322.637 hecc
166 Au45Be 0.010 -0.945 1b TTT 0.000 0.014 2322.637 hecc
167 Au45B 0.008 -0.086 1b TTT 0.000 0.011 2322.637 hecc
168 Au45C 0.008 0.082 1b TTT -0.000 0.012 2322.637 hecc
169 Au45N 0.009 0.380 1b TTT 0.000 0.012 2322.637 hecc
170 Au45O 0.007 0.619 1b TTT -0.000 0.011 2322.637 hecc
171 Au45F 0.009 0.960 1b TTT 0.000 0.012 2322.637 hecc
172 Au45Ne 0.008 -0.009 1b TTT 0.000 0.015 2322.637 hecc
173 Au45Na 0.007 -5.185 1b TTT 0.000 0.015 2322.637 hecc
174 Au45Mg 0.007 -3.233 1b TTT -0.000 0.014 2322.637 hecc
175 AlAu45 0.010 -1.311 1b TTT 0.000 0.013 2322.637 hecc