{ "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" [ [ 2.4718 1.858527 2.216013 ] [ 2.961187 3.9638 1.175243 ] [ 2.62986 4.035161 3.548452 ] [ 4.200659 2.412747 0.4103634 ] [ 4.64949 3.303863 2.581344 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4718e-10 1.858527e-10 2.216013e-10 ] [ 2.961187e-10 3.9638e-10 1.175243e-10 ] [ 2.62986e-10 4.035161000000001e-10 3.548452e-10 ] [ 4.200659e-10 2.412747e-10 4.103634e-11 ] [ 4.64949e-10 3.303863e-10 2.581344e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.3851873 -0.2423057 0.4480853 ] [ -4.5805141 5.5416999 -0.9996134 ] [ -0.9812842 -0.1926806 0.8947013 ] [ 2.5361239 -4.1933176 -2.094702 ] [ 2.640487 -0.9133961 1.7515288 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.171380917735482e-10 -3.882165308250137e-10 7.179117976988801e-10 ] [ -7.338792662727539e-09 8.878782092420137e-09 -1.601557232513295e-09 ] [ -1.572190616553383e-09 -3.087083551451004e-10 1.433469517269424e-09 ] [ 4.063318453508953e-09 -6.718435477660959e-09 -3.356082599593068e-09 ] [ 4.230526573780757e-09 -1.463421889006727e-09 2.806258517138059e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.061404 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.092667629603413e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.5860416 1.9020201 2.2301623 ] [ 2.8509 4.1835896 1.1261124 ] [ 2.5544795 3.9770945 3.569549 ] [ 4.2107069 2.2525442 0.4030115 ] [ 4.710868 3.2588495 2.6025802 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5860416e-10 1.9020201e-10 2.2301623e-10 ] [ 2.8509e-10 4.183589600000001e-10 1.1261124e-10 ] [ 2.5544795e-10 3.9770945e-10 3.569549e-10 ] [ 4.2107069e-10 2.2525442e-10 4.030115e-11 ] [ 4.710868e-10 3.2588495e-10 2.6025802e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.86e-05 -2.2e-05 -1.03e-05 ] [ -3.26e-05 6.7e-06 -1.76e-05 ] [ 9.8e-06 1.82e-05 3.68e-05 ] [ 4.05e-05 -1.4e-05 -2.23e-05 ] [ 3.1e-05 1.1e-05 1.35e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.786578441239999e-14 -3.5247885948e-14 -1.65024193302e-14 ] [ -5.22309582684e-14 1.07345834478e-14 -2.81983087584e-14 ] [ 1.57013310132e-14 2.915961473879999e-14 5.896010013119999e-14 ] [ 6.4888153677e-14 -2.243047287599999e-14 -3.572853893819999e-14 ] [ 4.966747565399999e-14 1.7623942974e-14 2.162938455899999e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.29999 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.291110984443366e-18 } }