ASE database

Displaying rows 1-25 out of 31

↓ ID ✕	Formula ✕	ads_site ✕	str_E ✕	slab_E ✕	Dipole_val ✕
1	Au₅₄H	2f	-168.070	-165.064	-0.123
2	Au₅₄He	2f	-165.069	-165.064	-0.011
3	Au₅₄Li	2f	-168.230	-165.064	-2.696
4	Au₅₄Be	2f	-169.147	-165.064	-0.238
5	Au₅₄B	2f	-171.055	-165.064	-0.022
6	Au₅₄C	2f	-171.207	-165.064	0.044
7	Au₅₄N	2f	-170.577	-165.064	0.360
8	Au₅₄O	2f	-169.926	-165.064	0.594
9	Au₅₄F	2f	-168.695	-165.064	1.029
10	Au₅₄Ne	2f	-165.085	-165.064	-0.012
11	Au₅₄Na	2f	-167.652	-165.064	-4.669
12	Au₅₄Mg	2f	-167.509	-165.064	-2.555
13	AlAu₅₄	2f	-169.611	-165.064	-0.805
14	Au₅₄Si	2f	-170.944	-165.064	-0.276
15	Au₅₄P	2f	-171.031	-165.064	0.008
16	Au₅₄S	2f	-169.906	-165.064	0.191
17	Au₅₄Cl	2f	-167.868	-165.064	0.752
18	Au₅₄Ar	2f	-165.095	-165.064	-0.077
19	Au₅₄H	1b	-168.428	-165.064	-0.004
20	Au₅₄He	1b	-165.069	-165.064	-0.017
21	Au₅₄Li	1b	-167.904	-165.064	-3.955
22	Au₅₄Be	1b	-167.816	-165.064	-1.093
23	Au₅₄B	1b	-169.754	-165.064	-0.008
24	Au₅₄C	1b	-170.497	-165.064	0.475
25	Au₅₄N	1b	-170.360	-165.064	0.930