ASE database

Displaying rows 1-8 out of 8
Formula ✕ str_E ✕ distance ✕ ads_E ✕ Energy ✕ atom_E ✕ ads_site ✕ Age ✕ PBC ✕
Au54H -168.070 0.464 -1.889 -168.070 -1.117 2f 15M TTT
Au54He -165.069 3.597 -0.007 -165.069 0.002 2f 15M TTT
Au54Li -168.230 1.620 -2.868 -168.230 -0.299 2f 15M TTT
Au54Be -169.147 0.461 -4.044 -169.147 -0.039 2f 15M TTT
Au54B -171.055 0.094 -5.643 -171.055 -0.349 2f 15M TTT
Au54C -171.207 0.055 -4.895 -171.207 -1.248 2f 15M TTT
Au54N -170.577 0.748 -2.390 -170.577 -3.124 2f 15M TTT
Au54O -169.926 0.843 -3.329 -169.926 -1.533 2f 15M TTT
Au54F -168.695 1.259 -3.208 -168.695 -0.424 2f 15M TTT
Au54Ne -165.085 3.424 -0.009 -165.085 -0.013 2f 15M TTT
Au54Na -167.652 2.111 -2.363 -167.652 -0.225 2f 15M TTT
Au54Mg -167.509 1.410 -2.441 -167.509 -0.004 2f 15M TTT
AlAu54 -169.611 0.934 -4.253 -169.611 -0.295 2f 15M TTT
Au54Si -170.944 0.866 -5.051 -170.944 -0.830 2f 15M TTT
Au54P -171.031 1.150 -4.079 -171.031 -1.888 2f 15M TTT
Au54S -169.906 1.251 -3.898 -169.906 -0.945 2f 15M TTT
Au54Cl -167.868 1.721 -2.562 -167.868 -0.243 2f 15M TTT
Au54Ar -165.095 3.651 -0.005 -165.095 -0.025 2f 15M TTT
Au54H -168.428 0.885 -2.247 -168.428 -1.117 1b 15M TTT
Au54He -165.069 3.568 -0.007 -165.069 0.002 1b 15M TTT
Au54Li -167.904 1.954 -2.541 -167.904 -0.299 1b 15M TTT
Au54Be -167.816 1.213 -2.713 -167.816 -0.039 1b 15M TTT
Au54B -169.754 0.861 -4.341 -169.754 -0.349 1b 15M TTT
Au54C -170.497 1.062 -4.185 -170.497 -1.248 1b 15M TTT
Au54N -170.360 1.146 -2.172 -170.360 -3.124 1b 15M TTT