{ "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" [ [ 1.931726 1.779285 1.793394 ] [ 2.022352 0.7174538 3.630998 ] [ 4.124201 0.9725878 2.711634 ] [ 3.467636 2.844975 3.645464 ] [ 5.471294 3.704408 2.165903 ] [ 3.262896 3.451778 1.529715 ] [ 3.831227 5.45457 3.339943 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.931726e-10 1.779285e-10 1.793394e-10 ] [ 2.022352e-10 7.174538e-11 3.630998e-10 ] [ 4.124201e-10 9.725878e-11 2.711634e-10 ] [ 3.467636e-10 2.844975e-10 3.645464e-10 ] [ 5.471294000000001e-10 3.704408e-10 2.165903e-10 ] [ 3.262896e-10 3.451778e-10 1.529715e-10 ] [ 3.831227000000001e-10 5.454570000000001e-10 3.339943e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.7654094 -0.2578131 -1.9193649 ] [ -0.2648866 -1.8402233 1.8262967 ] [ 0.832167 -2.0651387 -0.0163796 ] [ 0.100404 1.2017738 3.0878873 ] [ -6.8925301 -0.5804084 -2.3177752 ] [ 7.9902551 3.5418098 -0.6606642 ] [ 0.0 0.0 0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.828497666820556e-09 -4.130621213559725e-10 -3.07516156956413e-09 ] [ -4.243951176832013e-10 -2.948362748311425e-09 2.926049875384192e-09 ] [ 1.333278512001273e-09 -3.308716943849305e-09 -2.624301217805568e-11 ] [ 1.608649414348032e-10 1.925453885849975e-09 4.947340839725236e-09 ] [ -1.104305058438029e-08 -9.299167689959348e-10 -3.713485237710044e-09 ] [ 1.280179991544797e-08 5.674604856880324e-09 -1.058500735439536e-09 ] [ 0.0 0.0 0.0 ] ] } "unrelaxed-potential-energy" { "source-value" -9.3397718 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.496396402156713e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7497225 1.7070702 1.1266363 ] [ 2.1160378 0.4357964 2.8945245 ] [ 3.5500944 0.9868995 4.4736469 ] [ 4.5201557 2.9267594 4.8680633 ] [ 4.3763128 4.753499 1.4379233 ] [ 2.9307165 3.4283011 0.4304672 ] [ 4.8682924 4.686732 3.5857894 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7497225e-10 1.7070702e-10 1.1266363e-10 ] [ 2.1160378e-10 4.357964e-11 2.8945245e-10 ] [ 3.5500944e-10 9.868995000000001e-11 4.473646900000001e-10 ] [ 4.5201557e-10 2.9267594e-10 4.868063300000001e-10 ] [ 4.3763128e-10 4.753499e-10 1.4379233e-10 ] [ 2.9307165e-10 3.4283011e-10 4.304672e-11 ] [ 4.8682924e-10 4.686732e-10 3.5857894e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.022694 -0.7553163 0.5131159 ] [ -0.0884316 0.4178076 -0.5398848 ] [ -0.0028103 0.1971001 0.2081078 ] [ 0.0569262 0.0209008 -0.0960701 ] [ -0.2437034 -0.0672036 0.0635592 ] [ 0.2665668 0.5003901 -0.1322346 ] [ 0.0341463 -0.3136788 -0.0165933 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.63597962324352e-11 -1.210150117169159e-09 8.221022987407506e-10 ] [ -1.416830420599373e-10 6.694015687125582e-10 -8.64990804485284e-10 ] [ -4.50259695743424e-12 3.157891721773421e-10 3.334254517661223e-10 ] [ 9.120582675098497e-11 3.348677311601664e-11 -1.539212681779181e-10 ] [ -3.904558898894707e-10 -1.076720367535949e-10 1.018330642767514e-10 ] [ 4.270870948414694e-10 8.01713319499774e-10 -2.118631845808397e-10 ] [ 5.470840354682303e-11 -5.025688398005991e-10 -2.658539732192064e-11 ] ] } "relaxed-potential-energy" { "source-value" -18.11329 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.902068976377043e-18 } }