ASE database

Displaying rows 1-8 out of 8

↓ ID ✕	Formula ✕	Maximum force ✕	PBC ✕	Maximum stress ✕	atom_E ✕	Charge ✕	str_E ✕	Energy ✕
1	Au₅₄H	0.008	TTT	0.012	-1.117	0.000	-168.070	-168.070
2	Au₅₄He	0.006	TTT	0.011	0.002	0.000	-165.069	-165.069
3	Au₅₄Li	0.008	TTT	0.011	-0.299	0.000	-168.230	-168.230
4	Au₅₄Be	0.008	TTT	0.010	-0.039	0.000	-169.147	-169.147
5	Au₅₄B	0.008	TTT	0.011	-0.349	0.000	-171.055	-171.055
6	Au₅₄C	0.009	TTT	0.011	-1.248	0.000	-171.207	-171.207
7	Au₅₄N	0.008	TTT	0.011	-3.124	0.000	-170.577	-170.577
8	Au₅₄O	0.009	TTT	0.011	-1.533	0.000	-169.926	-169.926
9	Au₅₄F	0.005	TTT	0.011	-0.424	0.000	-168.695	-168.695
10	Au₅₄Ne	0.010	TTT	0.011	-0.013	0.000	-165.085	-165.085
11	Au₅₄Na	0.005	TTT	0.011	-0.225	0.000	-167.652	-167.652
12	Au₅₄Mg	0.010	TTT	0.010	-0.004	0.000	-167.509	-167.509
13	AlAu₅₄	0.010	TTT	0.010	-0.295	0.000	-169.611	-169.611
14	Au₅₄Si	0.006	TTT	0.010	-0.830	0.000	-170.944	-170.944
15	Au₅₄P	0.006	TTT	0.011	-1.888	0.000	-171.031	-171.031
16	Au₅₄S	0.007	TTT	0.011	-0.945	0.000	-169.906	-169.906
17	Au₅₄Cl	0.010	TTT	0.011	-0.243	0.000	-167.868	-167.868
18	Au₅₄Ar	0.006	TTT	0.011	-0.025	0.000	-165.095	-165.095
19	Au₅₄H	0.010	TTT	0.011	-1.117	0.000	-168.428	-168.428
20	Au₅₄He	0.009	TTT	0.011	0.002	0.000	-165.069	-165.069
21	Au₅₄Li	0.009	TTT	0.012	-0.299	0.000	-167.904	-167.904
22	Au₅₄Be	0.009	TTT	0.012	-0.039	0.000	-167.816	-167.816
23	Au₅₄B	0.009	TTT	0.011	-0.349	0.000	-169.754	-169.754
24	Au₅₄C	0.006	TTT	0.011	-1.248	0.000	-170.497	-170.497
25	Au₅₄N	0.010	TTT	0.011	-3.124	0.000	-170.360	-170.360