ASE database

Displaying rows 1-8 out of 8
↓ ID ✕ Formula ✕ Username ✕ Mass ✕ Charge ✕ distance ✕ Energy ✕ Number of atoms ✕ PBC ✕ Calculator ✕
1 Au54H hecc 10637.203 0.000 0.464 -168.070 55 TTT vasp
2 Au54He hecc 10640.197 0.000 3.597 -165.069 55 TTT vasp
3 Au54Li hecc 10643.135 0.000 1.620 -168.230 55 TTT vasp
4 Au54Be hecc 10645.207 0.000 0.461 -169.147 55 TTT vasp
5 Au54B hecc 10647.005 0.000 0.094 -171.055 55 TTT vasp
6 Au54C hecc 10648.206 0.000 0.055 -171.207 55 TTT vasp
7 Au54N hecc 10650.202 0.000 0.748 -170.577 55 TTT vasp
8 Au54O hecc 10652.194 0.000 0.843 -169.926 55 TTT vasp
9 Au54F hecc 10655.193 0.000 1.259 -168.695 55 TTT vasp
10 Au54Ne hecc 10656.374 0.000 3.424 -165.085 55 TTT vasp
11 Au54Na hecc 10659.184 0.000 2.111 -167.652 55 TTT vasp
12 Au54Mg hecc 10660.500 0.000 1.410 -167.509 55 TTT vasp
13 AlAu54 hecc 10663.176 0.000 0.934 -169.611 55 TTT vasp
14 Au54Si hecc 10664.280 0.000 0.866 -170.944 55 TTT vasp
15 Au54P hecc 10667.168 0.000 1.150 -171.031 55 TTT vasp
16 Au54S hecc 10668.255 0.000 1.251 -169.906 55 TTT vasp
17 Au54Cl hecc 10671.645 0.000 1.721 -167.868 55 TTT vasp
18 Au54Ar hecc 10676.143 0.000 3.651 -165.095 55 TTT vasp
19 Au54H hecc 10637.203 0.000 0.885 -168.428 55 TTT vasp
20 Au54He hecc 10640.197 0.000 3.568 -165.069 55 TTT vasp
21 Au54Li hecc 10643.135 0.000 1.954 -167.904 55 TTT vasp
22 Au54Be hecc 10645.207 0.000 1.213 -167.816 55 TTT vasp
23 Au54B hecc 10647.005 0.000 0.861 -169.754 55 TTT vasp
24 Au54C hecc 10648.206 0.000 1.062 -170.497 55 TTT vasp
25 Au54N hecc 10650.202 0.000 1.146 -170.360 55 TTT vasp