{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.7440121 1.644003 0.1699327 ] [ 1.624629 1.787277 2.54743 ] [ 2.897237 1.241702 0.9240311 ] [ 2.052276 3.648887 1.374272 ] [ 4.460812 2.919724 2.096642 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.440121e-11 1.644003e-10 1.699327e-11 ] [ 1.624629e-10 1.787277e-10 2.54743e-10 ] [ 2.897237e-10 1.241702e-10 9.240311e-11 ] [ 2.052276e-10 3.648887e-10 1.374272e-10 ] [ 4.460812e-10 2.919724e-10 2.096642e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.8623383 -0.1052766 -1.8525134 ] [ -1.7785678 -0.6408912 4.4364034 ] [ 4.3619561 -2.5467161 -1.7873792 ] [ 0.810221 3.5414358 0.0047332 ] [ -1.531271 -0.2485519 -0.801244 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.983794884280417e-09 -1.686717072373133e-10 -2.968053659198718e-09 ] [ -2.84957974766769e-09 -1.026820897116457e-09 7.107901807917631e-09 ] [ 6.988624084375947e-09 -4.080288995234955e-09 -2.863697166744208e-09 ] [ 1.298117143881197e-09 5.674005642824144e-09 7.58342238157056e-12 ] [ -2.453366596309037e-09 -3.982240432354195e-10 -1.283734404356275e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.5290123 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.046063086397564e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.4515587 2.1338324 -0.0862421 ] [ 1.6228928 1.7095631 2.9322735 ] [ 2.9266204 0.8173323 1.1889268 ] [ 1.7849668 3.6793054 1.6559951 ] [ 3.9929276 2.9015598 1.4213546 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.4515587e-10 2.1338324e-10 -8.62421e-12 ] [ 1.6228928e-10 1.7095631e-10 2.9322735e-10 ] [ 2.9266204e-10 8.173323e-11 1.1889268e-10 ] [ 1.7849668e-10 3.6793054e-10 1.6559951e-10 ] [ 3.9929276e-10 2.9015598e-10 1.4213546e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1e-06 2.5e-06 -3e-06 ] [ -1.4e-06 -9e-07 3.1e-06 ] [ 2.2e-06 -1.3e-06 1.6e-06 ] [ -2.7e-06 6e-07 1e-07 ] [ 2.9e-06 -9e-07 -1.9e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.6021766208e-15 4.005441552e-15 -4.8065298624e-15 ] [ -2.24304726912e-15 -1.44195895872e-15 4.96674752448e-15 ] [ 3.52478856576e-15 -2.08282960704e-15 2.56348259328e-15 ] [ -4.32587687616e-15 9.6130597248e-16 1.6021766208e-16 ] [ 4.646312200320001e-15 -1.44195895872e-15 -3.04413557952e-15 ] ] } "relaxed-potential-energy" { "source-value" -8.7233245 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.397630656955185e-18 } }