{ "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" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.272226 1.517825 2.823083 ] [ 2.079314 3.025232 4.309487 ] [ 1.624731 3.89644 2.167347 ] [ 4.204366 1.580563 1.938725 ] [ 4.130904 2.338344 4.256427 ] [ 3.588528 3.628489 1.149971 ] [ 3.881136 4.134812 3.114475 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.272226e-10 1.517825e-10 2.823083e-10 ] [ 2.079314e-10 3.025232e-10 4.309487e-10 ] [ 1.624731e-10 3.89644e-10 2.167347e-10 ] [ 4.204366000000001e-10 1.580563e-10 1.938725e-10 ] [ 4.130904e-10 2.338344e-10 4.256427000000001e-10 ] [ 3.588528e-10 3.628489e-10 1.149971e-10 ] [ 3.881136e-10 4.134812e-10 3.114475e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 140.454581 218.6753815 31.2625718 ] [ 147.0690094 -45.3419099 -192.3503204 ] [ 163.8964044 -108.9583317 66.8526804 ] [ -157.1266684 192.749165 132.0757289 ] [ -128.6191356 82.2198395 -177.9271505 ] [ -37.2515727 -78.192676 181.2981895 ] [ -128.4226181 -261.1514683 -41.2116997 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.250330478164603e-07 3.503565866703359e-07 5.008816205670732e-08 ] [ 2.356305304462064e-07 -7.264574858271327e-08 -3.081791888872935e-07 ] [ 2.625909895262948e-07 -1.745704931293615e-07 1.071098024571498e-07 ] [ -2.517446766887461e-07 3.088182083860106e-07 2.116086467620985e-07 ] [ -2.060705737435975e-07 1.317307056981302e-07 -2.850707230853014e-07 ] [ -5.968359935969228e-08 -1.252784784371326e-07 2.904717230034041e-07 ] [ -2.057557179969254e-07 -4.184107804450516e-07 -6.60284223067648e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 51.52721972363283 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 8.255570745618846e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.272226 1.517825 2.823083 ] [ 2.079314 3.025232 4.309487 ] [ 1.624731 3.89644 2.167347 ] [ 4.204366 1.580563 1.938725 ] [ 4.130904 2.338344 4.256427 ] [ 3.588528 3.628489 1.149971 ] [ 3.881136 4.134812 3.114475 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.272226e-10 1.517825e-10 2.823083e-10 ] [ 2.079314e-10 3.025232e-10 4.309487e-10 ] [ 1.624731e-10 3.89644e-10 2.167347e-10 ] [ 4.204366000000001e-10 1.580563e-10 1.938725e-10 ] [ 4.130904e-10 2.338344e-10 4.256427000000001e-10 ] [ 3.588528e-10 3.628489e-10 1.149971e-10 ] [ 3.881136e-10 4.134812e-10 3.114475e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 140.454581 218.6753815 31.2625718 ] [ 147.0690094 -45.3419099 -192.3503204 ] [ 163.8964044 -108.9583317 66.8526804 ] [ -157.1266684 192.749165 132.0757289 ] [ -128.6191356 82.2198395 -177.9271505 ] [ -37.2515727 -78.192676 181.2981895 ] [ -128.4226181 -261.1514683 -41.2116997 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.250330478164603e-07 3.503565866703359e-07 5.008816205670732e-08 ] [ 2.356305304462064e-07 -7.264574858271327e-08 -3.081791888872935e-07 ] [ 2.625909895262948e-07 -1.745704931293615e-07 1.071098024571498e-07 ] [ -2.517446766887461e-07 3.088182083860106e-07 2.116086467620985e-07 ] [ -2.060705737435975e-07 1.317307056981302e-07 -2.850707230853014e-07 ] [ -5.968359935969228e-08 -1.252784784371326e-07 2.904717230034041e-07 ] [ -2.057557179969254e-07 -4.184107804450516e-07 -6.60284223067648e-08 ] ] } "relaxed-potential-energy" { "source-value" 51.52721972363283 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 8.255570745618846e-18 } }