{ "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" [ [ 2.316837 2.864638 1.901515 ] [ 3.52699 0.8132212 1.584521 ] [ 4.498469 2.850966 1.401087 ] [ 3.329161 3.035367 4.525662 ] [ 4.789001 1.444676 3.549999 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.316837e-10 2.864638e-10 1.901515e-10 ] [ 3.52699e-10 8.132212e-11 1.584521e-10 ] [ 4.498469e-10 2.850966e-10 1.401087e-10 ] [ 3.329161e-10 3.035367e-10 4.525662e-10 ] [ 4.789001e-10 1.444676e-10 3.549999e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.1719119 -0.4352068 1.0301051 ] [ -0.3971383 0.1029647 0.3338316 ] [ 1.1534888 0.0716537 0.3039302 ] [ -0.0697228 -0.4060422 -1.0777743 ] [ -0.5147158 0.6666305 -0.5900926 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.754332270173075e-10 -6.972781601731814e-10 1.650410308186846e-09 ] [ -6.362856994842567e-10 1.649676351076858e-10 5.348571848042572e-10 ] [ 1.848092787714647e-09 1.14801882933817e-10 4.869498607950682e-10 ] [ -1.117082400967142e-10 -6.505513198981977e-10 -1.726784785959085e-09 ] [ -8.246656211163686e-10 1.068059801812214e-09 -9.45432567827086e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -4.50888039923495 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.224022761637609e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.3820465 2.9442152 2.0929339 ] [ 3.420499 0.8480083 1.7268879 ] [ 4.6375195 2.7709739 1.3934199 ] [ 3.1278593 2.8587939 4.321582 ] [ 4.8925337 1.5868769 3.4279602 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3820465e-10 2.9442152e-10 2.0929339e-10 ] [ 3.420499e-10 8.480083000000001e-11 1.7268879e-10 ] [ 4.6375195e-10 2.7709739e-10 1.3934199e-10 ] [ 3.1278593e-10 2.8587939e-10 4.321582e-10 ] [ 4.892533700000001e-10 1.5868769e-10 3.4279602e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.31e-05 2.75e-05 1.16e-05 ] [ -1.22e-05 -4.28e-05 -1.26e-05 ] [ -8.7e-06 -1.2e-06 -2.43e-05 ] [ -2.07e-05 -2.07e-05 1.89e-05 ] [ -1.5e-06 3.73e-05 6.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.905381235648e-14 4.4059857072e-14 1.858524880128e-14 ] [ -1.954655477376e-14 -6.857315937023999e-14 -2.018742542208e-14 ] [ -1.393893660096e-14 -1.92261194496e-15 -3.893289188544e-14 ] [ -3.316505605055999e-14 -3.316505605055999e-14 3.028113813312e-14 ] [ -2.4032649312e-15 5.976118795584e-14 1.04141480352e-14 ] ] } "relaxed-potential-energy" { "source-value" -5.092110399234951 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.158460232186793e-19 } }