ASE database

ID Formula Dipole_val Energy Age Maximum stress atom_E
301 Ag72Al -0.564 -186.167 15M 0.005 -0.295
302 Ag72Si 0.739 -187.205 15M 0.004 -0.830
303 Ag72P 1.822 -187.772 15M 0.004 -1.888
304 Ag72S 2.638 -187.928 15M 0.005 -0.945
305 Ag72Cl 2.310 -187.145 15M 0.005 -0.243
306 Ag72Ar -0.101 -183.656 15M 0.005 -0.025
307 Ag72H 1.064 -186.368 15M 0.005 -1.117
308 Ag72He -0.030 -183.632 15M 0.005 0.002
309 Ag72Li -4.506 -185.437 15M 0.005 -0.299
310 Ag72Be -0.563 -184.687 15M 0.005 -0.039
311 Ag72B 0.753 -186.083 15M 0.005 -0.349
312 Ag72C 1.741 -186.792 15M 0.005 -1.248
313 Ag72N 2.596 -187.242 15M 0.005 -3.124
314 Ag72O 3.334 -187.655 15M 0.005 -1.533
315 Ag72F 3.544 -187.652 15M 0.005 -0.424
316 Ag72Ne -0.024 -183.652 15M 0.005 -0.013
317 Ag72Na -5.297 -185.163 15M 0.005 -0.225
318 Ag72Mg -2.114 -184.375 15M 0.005 -0.004
319 Ag72Al -1.111 -185.865 15M 0.005 -0.295
320 Ag72Si 0.492 -186.574 15M 0.006 -0.830
321 Ag72P 2.057 -186.895 15M 0.006 -1.888
322 Ag72S 3.079 -187.092 15M 0.005 -0.945
323 Ag72Cl 3.496 -186.770 15M 0.005 -0.243
324 Ag72Ar -0.103 -183.665 15M 0.005 -0.025
325 Ag45H -0.013 -119.526 15M 0.005 -1.120