ASE database

Displaying rows 1-25 out of 594

↓ ID ✕	Formula ✕	Number of atoms ✕	atom_E ✕	Maximum force ✕	Energy ✕	ads_site ✕	Username ✕
1	Au₅₄H	55	-1.117	0.008	-168.070	2f	hecc
2	Au₅₄He	55	0.002	0.006	-165.069	2f	hecc
3	Au₅₄Li	55	-0.299	0.008	-168.230	2f	hecc
4	Au₅₄Be	55	-0.039	0.008	-169.147	2f	hecc
5	Au₅₄B	55	-0.349	0.008	-171.055	2f	hecc
6	Au₅₄C	55	-1.248	0.009	-171.207	2f	hecc
7	Au₅₄N	55	-3.124	0.008	-170.577	2f	hecc
8	Au₅₄O	55	-1.533	0.009	-169.926	2f	hecc
9	Au₅₄F	55	-0.424	0.005	-168.695	2f	hecc
10	Au₅₄Ne	55	-0.013	0.010	-165.085	2f	hecc
11	Au₅₄Na	55	-0.225	0.005	-167.652	2f	hecc
12	Au₅₄Mg	55	-0.004	0.010	-167.509	2f	hecc
13	AlAu₅₄	55	-0.295	0.010	-169.611	2f	hecc
14	Au₅₄Si	55	-0.830	0.006	-170.944	2f	hecc
15	Au₅₄P	55	-1.888	0.006	-171.031	2f	hecc
16	Au₅₄S	55	-0.945	0.007	-169.906	2f	hecc
17	Au₅₄Cl	55	-0.243	0.010	-167.868	2f	hecc
18	Au₅₄Ar	55	-0.025	0.006	-165.095	2f	hecc
19	Au₅₄H	55	-1.117	0.010	-168.428	1b	hecc
20	Au₅₄He	55	0.002	0.009	-165.069	1b	hecc
21	Au₅₄Li	55	-0.299	0.009	-167.904	1b	hecc
22	Au₅₄Be	55	-0.039	0.009	-167.816	1b	hecc
23	Au₅₄B	55	-0.349	0.009	-169.754	1b	hecc
24	Au₅₄C	55	-1.248	0.006	-170.497	1b	hecc
25	Au₅₄N	55	-3.124	0.010	-170.360	1b	hecc

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