ASE database

Formula ads_E Mass plane_index atom_E Maximum force
Au54H -1.889 10637.203 100 -1.117 0.008
Au54He -0.007 10640.197 100 0.002 0.006
Au54Li -2.868 10643.135 100 -0.299 0.008
Au54Be -4.044 10645.207 100 -0.039 0.008
Au54B -5.643 10647.005 100 -0.349 0.008
Au54C -4.895 10648.206 100 -1.248 0.009
Au54N -2.390 10650.202 100 -3.124 0.008
Au54O -3.329 10652.194 100 -1.533 0.009
Au54F -3.208 10655.193 100 -0.424 0.005
Au54Ne -0.009 10656.374 100 -0.013 0.010
Au54Na -2.363 10659.184 100 -0.225 0.005
Au54Mg -2.441 10660.500 100 -0.004 0.010
AlAu54 -4.253 10663.176 100 -0.295 0.010
Au54Si -5.051 10664.280 100 -0.830 0.006
Au54P -4.079 10667.168 100 -1.888 0.006
Au54S -3.898 10668.255 100 -0.945 0.007
Au54Cl -2.562 10671.645 100 -0.243 0.010
Au54Ar -0.005 10676.143 100 -0.025 0.006
Au54H -2.247 10637.203 100 -1.117 0.010
Au54He -0.007 10640.197 100 0.002 0.009
Au54Li -2.541 10643.135 100 -0.299 0.009
Au54Be -2.713 10645.207 100 -0.039 0.009
Au54B -4.341 10647.005 100 -0.349 0.009
Au54C -4.185 10648.206 100 -1.248 0.006
Au54N -2.172 10650.202 100 -3.124 0.010