{ "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" [ [ 0.9320143 3.012582 2.150962 ] [ 2.172573 2.316103 4.293659 ] [ 2.198257 4.51425 3.345177 ] [ 3.106694 2.5483 1.973249 ] [ 3.92193 5.175884 1.747773 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.320143e-11 3.012582e-10 2.150962e-10 ] [ 2.172573e-10 2.316103e-10 4.293659e-10 ] [ 2.198257e-10 4.51425e-10 3.345177e-10 ] [ 3.106694e-10 2.5483e-10 1.973249e-10 ] [ 3.92193e-10 5.175884e-10 1.747773e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.2713203 -0.2836818 0.0119364 ] [ 0.1441618 0.1432353 -0.5159939 ] [ 0.7458109 1.1161441 -0.1777594 ] [ 1.5433188 1.0848671 -0.2703657 ] [ -1.1619713 -2.0605647 0.9521827 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.036879662208442e-09 -4.545083477064614e-10 1.912422101651712e-11 ] [ 2.309726655724454e-10 2.294882489332743e-10 -8.267133630554132e-10 ] [ 1.194920787517807e-09 1.788259982463857e-09 -2.848019548074356e-10 ] [ 2.472669299801111e-09 1.738148704295096e-09 -4.331736036062266e-10 ] [ -1.861683250900583e-09 -3.301388587985766e-09 1.52556486067022e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -13.259208 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.124359306792433e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.2344972 3.3490763 1.9968207 ] [ 2.2650331 2.4527218 4.0245371 ] [ 2.0985384 4.7937959 3.769708 ] [ 3.4498883 2.3152185 1.9872564 ] [ 3.2835114 4.6563066 1.7324978 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2344972e-10 3.3490763e-10 1.9968207e-10 ] [ 2.2650331e-10 2.4527218e-10 4.0245371e-10 ] [ 2.0985384e-10 4.7937959e-10 3.769708e-10 ] [ 3.4498883e-10 2.3152185e-10 1.9872564e-10 ] [ 3.2835114e-10 4.6563066e-10 1.7324978e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.9e-05 6.5e-06 -2.38e-05 ] [ -2.3e-05 -5.01e-05 2.93e-05 ] [ 1.46e-05 4.17e-05 3.12e-05 ] [ 4.05e-05 -3.34e-05 3.1e-06 ] [ -1.31e-05 3.53e-05 -3.99e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.04413557952e-14 1.04141480352e-14 -3.813180357504e-14 ] [ -3.68500622784e-14 -8.026904870208e-14 4.694377498944e-14 ] [ 2.339177866368e-14 6.681076508736e-14 4.998791056896e-14 ] [ 6.488815314240001e-14 -5.351269913472e-14 4.96674752448e-15 ] [ -2.098851373248e-14 5.655683471424e-14 -6.392684716992e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.50509 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.323971608059987e-18 } }