ASE database

Displaying rows 1-25 out of 594

↓ ID ✕	Formula ✕	Maximum stress ✕	ads_E ✕	Calculator ✕	ads_site ✕	Energy ✕
1	Au₅₄H	0.012	-1.889	vasp	2f	-168.070
2	Au₅₄He	0.011	-0.007	vasp	2f	-165.069
3	Au₅₄Li	0.011	-2.868	vasp	2f	-168.230
4	Au₅₄Be	0.010	-4.044	vasp	2f	-169.147
5	Au₅₄B	0.011	-5.643	vasp	2f	-171.055
6	Au₅₄C	0.011	-4.895	vasp	2f	-171.207
7	Au₅₄N	0.011	-2.390	vasp	2f	-170.577
8	Au₅₄O	0.011	-3.329	vasp	2f	-169.926
9	Au₅₄F	0.011	-3.208	vasp	2f	-168.695
10	Au₅₄Ne	0.011	-0.009	vasp	2f	-165.085
11	Au₅₄Na	0.011	-2.363	vasp	2f	-167.652
12	Au₅₄Mg	0.010	-2.441	vasp	2f	-167.509
13	AlAu₅₄	0.010	-4.253	vasp	2f	-169.611
14	Au₅₄Si	0.010	-5.051	vasp	2f	-170.944
15	Au₅₄P	0.011	-4.079	vasp	2f	-171.031
16	Au₅₄S	0.011	-3.898	vasp	2f	-169.906
17	Au₅₄Cl	0.011	-2.562	vasp	2f	-167.868
18	Au₅₄Ar	0.011	-0.005	vasp	2f	-165.095
19	Au₅₄H	0.011	-2.247	vasp	1b	-168.428
20	Au₅₄He	0.011	-0.007	vasp	1b	-165.069
21	Au₅₄Li	0.012	-2.541	vasp	1b	-167.904
22	Au₅₄Be	0.012	-2.713	vasp	1b	-167.816
23	Au₅₄B	0.011	-4.341	vasp	1b	-169.754
24	Au₅₄C	0.011	-4.185	vasp	1b	-170.497
25	Au₅₄N	0.011	-2.172	vasp	1b	-170.360

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