ASE database

ID Formula Dipole_val atom_E PBC
301 Ag72Al -0.564 -0.295 TTT
302 Ag72Si 0.739 -0.830 TTT
303 Ag72P 1.822 -1.888 TTT
304 Ag72S 2.638 -0.945 TTT
305 Ag72Cl 2.310 -0.243 TTT
306 Ag72Ar -0.101 -0.025 TTT
307 Ag72H 1.064 -1.117 TTT
308 Ag72He -0.030 0.002 TTT
309 Ag72Li -4.506 -0.299 TTT
310 Ag72Be -0.563 -0.039 TTT
311 Ag72B 0.753 -0.349 TTT
312 Ag72C 1.741 -1.248 TTT
313 Ag72N 2.596 -3.124 TTT
314 Ag72O 3.334 -1.533 TTT
315 Ag72F 3.544 -0.424 TTT
316 Ag72Ne -0.024 -0.013 TTT
317 Ag72Na -5.297 -0.225 TTT
318 Ag72Mg -2.114 -0.004 TTT
319 Ag72Al -1.111 -0.295 TTT
320 Ag72Si 0.492 -0.830 TTT
321 Ag72P 2.057 -1.888 TTT
322 Ag72S 3.079 -0.945 TTT
323 Ag72Cl 3.496 -0.243 TTT
324 Ag72Ar -0.103 -0.025 TTT
325 Ag45H -0.013 -1.120 TTT
326 Ag45He -0.023 0.002 TTT
327 Ag45Li -3.187 -0.299 TTT
328 Ag45Be -0.505 -0.039 TTT
329 Ag45B 0.380 -0.349 TTT
330 Ag45C 0.626 -1.250 TTT
331 Ag45N 0.956 -3.120 TTT
332 Ag45O 1.151 -1.530 TTT
333 Ag45F 1.191 -0.424 TTT
334 Ag45Ne -0.010 -0.013 TTT
335 Ag45Na -4.251 -0.225 TTT
336 Ag45Mg -2.262 -0.004 TTT
337 Ag45Al -0.599 -0.295 TTT
338 Ag45Si 0.279 -0.830 TTT
339 Ag45P 1.036 -1.890 TTT
340 Ag45S 1.333 -0.945 TTT
341 Ag45Cl 1.184 -0.243 TTT
342 Ag45Ar -0.027 -0.025 TTT
343 Ag45H -0.019 -1.117 TTT
344 Ag45He -0.021 0.002 TTT
345 Ag45Li -3.171 -0.299 TTT
346 Ag45Be -0.492 -0.039 TTT
347 Ag45B 0.440 -0.349 TTT
348 Ag45C 0.682 -1.248 TTT
349 Ag45N 0.931 -3.124 TTT
350 Ag45O 1.077 -1.533 TTT
351 Ag45F 1.110 -0.424 TTT
352 Ag45Ne -0.009 -0.013 TTT
353 Ag45Na -4.252 -0.225 TTT
354 Ag45Mg -2.246 -0.004 TTT
355 Ag45Al -0.592 -0.295 TTT
356 Ag45Si 0.270 -0.830 TTT
357 Ag45P 1.001 -1.888 TTT
358 Ag45S 1.277 -0.945 TTT
359 Ag45Cl 1.132 -0.243 TTT
360 Ag45Ar -0.051 -0.025 TTT
361 Ag45H 0.067 -1.120 TTT
362 Ag45He -0.023 0.002 TTT
363 Ag45Li -3.180 -0.299 TTT
364 Ag45Be -0.427 -0.039 TTT
365 Ag45B 0.308 -0.349 TTT
366 Ag45C 0.681 -1.250 TTT
367 Ag45N 0.936 -3.120 TTT
368 Ag45O 1.074 -1.530 TTT
369 Ag45F 1.109 -0.424 TTT
370 Ag45Ne -0.007 -0.013 TTT
371 Ag45Na -4.262 -0.225 TTT
372 Ag45Mg -2.208 -0.004 TTT
373 Ag45Al -0.587 -0.295 TTT
374 Ag45Si 0.259 -0.830 TTT
375 Ag45P 1.000 -1.890 TTT
376 Ag45S 1.274 -0.945 TTT
377 Ag45Cl 1.389 -0.243 TTT
378 Ag45Ar -0.053 -0.025 TTT
379 Ag45H 0.382 -1.117 TTT
380 Ag45He -0.012 0.002 TTT
381 Ag45Li -3.603 -0.299 TTT
382 Ag45Be -0.770 -0.039 TTT
383 Ag45B 0.500 -0.349 TTT
384 Ag45C 1.149 -1.248 TTT
385 Ag45N 1.751 -3.124 TTT
386 Ag45O 2.342 -1.533 TTT
387 Ag45F 2.574 -0.424 TTT
388 Ag45Ne -0.014 -0.013 TTT
389 Ag45Na -4.477 -0.225 TTT
390 Ag45Mg -2.119 -0.004 TTT
391 Ag45Al -0.850 -0.295 TTT
392 Ag45Si 0.159 -0.830 TTT
393 Ag45P 1.008 -1.888 TTT
394 Ag45S 1.914 -0.945 TTT
395 Ag45Cl 2.419 -0.243 TTT
396 Ag45Ar -0.098 -0.025 TTT
397 Cu54H -0.040 -1.117 TTT
398 Cu54He -0.013 0.002 TTT
399 Cu54Li -2.989 -0.299 TTT
400 BeCu54 -0.069 -0.039 TTT