ASE database

Displaying rows 26-50 out of 594
↓ ID ✕ Formula ✕ atom_E ✕ Calculator ✕ ads_site ✕ Maximum stress ✕
26 Au54O -1.533 vasp 1b 0.011
27 Au54F -0.424 vasp 1b 0.011
28 Au54Ne -0.013 vasp 1b 0.011
29 Au54Na -0.225 vasp 1b 0.011
30 Au54Mg -0.004 vasp 1b 0.012
31 AlAu54 -0.295 vasp 1b 0.012
32 Au54Si -0.830 vasp 1b 0.012
33 Au54P -1.888 vasp 1b 0.011
34 Au54S -0.945 vasp 1b 0.011
35 Au54Cl -0.243 vasp 1b 0.011
36 Au54Ar -0.025 vasp 1b 0.011
37 Au54H -1.117 vasp 0t 0.011
38 Au54He 0.002 vasp 0t 0.011
39 Au54Li -0.299 vasp 0t 0.011
40 Au54Be -0.039 vasp 0t 0.011
41 Au54B -0.349 vasp 0t 0.011
42 Au54C -1.248 vasp 0t 0.011
43 Au54N -3.124 vasp 0t 0.011
44 Au54O -1.533 vasp 0t 0.010
45 Au54F -0.424 vasp 0t 0.010
46 Au54Ne -0.013 vasp 0t 0.011
47 Au54Na -0.225 vasp 0t 0.011
48 Au54Mg -0.004 vasp 0t 0.011
49 AlAu54 -0.295 vasp 0t 0.011
50 Au54Si -0.830 vasp 0t 0.011