ASE database

Displaying rows 1-8 out of 8

Formula ✕	Calculator ✕	Dipole_val ✕	str_E ✕
Au₅₄H	vasp	-0.123	-168.070
Au₅₄He	vasp	-0.011	-165.069
Au₅₄Li	vasp	-2.696	-168.230
Au₅₄Be	vasp	-0.238	-169.147
Au₅₄B	vasp	-0.022	-171.055
Au₅₄C	vasp	0.044	-171.207
Au₅₄N	vasp	0.360	-170.577
Au₅₄O	vasp	0.594	-169.926
Au₅₄F	vasp	1.029	-168.695
Au₅₄Ne	vasp	-0.012	-165.085
Au₅₄Na	vasp	-4.669	-167.652
Au₅₄Mg	vasp	-2.555	-167.509
AlAu₅₄	vasp	-0.805	-169.611
Au₅₄Si	vasp	-0.276	-170.944
Au₅₄P	vasp	0.008	-171.031
Au₅₄S	vasp	0.191	-169.906
Au₅₄Cl	vasp	0.752	-167.868
Au₅₄Ar	vasp	-0.077	-165.095
Au₅₄H	vasp	-0.004	-168.428
Au₅₄He	vasp	-0.017	-165.069
Au₅₄Li	vasp	-3.955	-167.904
Au₅₄Be	vasp	-1.093	-167.816
Au₅₄B	vasp	-0.008	-169.754
Au₅₄C	vasp	0.475	-170.497
Au₅₄N	vasp	0.930	-170.360