{ "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" [ [ 0.9991242 0.9479007 1.187372 ] [ 1.085399 0.1016804 2.948528 ] [ 2.969901 0.5974891 1.991295 ] [ 2.924101 2.886024 0.3835606 ] [ 2.264584 2.996261 2.274235 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.991242000000001e-11 9.479007e-11 1.187372e-10 ] [ 1.085399e-10 1.016804e-11 2.948528e-10 ] [ 2.969901e-10 5.974891e-11 1.991295e-10 ] [ 2.924101e-10 2.886024e-10 3.835606e-11 ] [ 2.264584e-10 2.996261e-10 2.274235e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.1155194 5.7502333 -12.1421197 ] [ -3.6312434 -6.0176594 12.3602257 ] [ 8.7467628 0.2674261 -0.2181061 ] [ 2.0125928 -0.336401 -5.7696126 ] [ -2.0125928 0.336401 5.7696126 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.1959656534537e-09 9.212889433308711e-09 -1.945382047057109e-08 ] [ -5.817893327846715e-09 -9.641353282050459e-09 1.980326480750629e-08 ] [ 1.401385898130042e-08 4.284638487417474e-10 -3.494444971528673e-10 ] [ 3.224529157916635e-09 -5.389738218542339e-10 -9.243938494951988e-09 ] [ -3.224529157916635e-09 5.389738218542339e-10 9.243938494951988e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -3.2454273 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.199747787405707e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.9032382 1.053779 0.9637353 ] [ 1.0187419 -0.008722 3.1752923 ] [ 3.1324441 0.6020132 1.9881673 ] [ 2.9695601 2.8784256 0.2532406 ] [ 2.2191249 3.0038594 2.404555 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.032382e-11 1.053779e-10 9.637353e-11 ] [ 1.0187419e-10 -8.722000000000001e-13 3.1752923e-10 ] [ 3.1324441e-10 6.020132000000001e-11 1.9881673e-10 ] [ 2.9695601e-10 2.8784256e-10 2.532406e-11 ] [ 2.2191249e-10 3.0038594e-10 2.404555e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0625096 0.1374016 -0.2878316 ] [ -0.006479 -0.1334217 0.276903 ] [ 0.0689886 -0.0039799 0.0109286 ] [ 0.0513948 -0.0085905 -0.1473364 ] [ -0.0513948 0.0085905 0.1473364 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.001514205206864e-10 2.201416329942144e-10 -4.611570640468344e-10 ] [ -1.0380502411686e-11 -2.137651302085578e-10 4.43647516484502e-10 ] [ 1.105319229323724e-10 -6.376502785656598e-12 1.75095475623324e-11 ] [ 8.234354766910319e-11 -1.3763498374377e-11 -2.360589374176776e-10 ] [ -8.234354766910319e-11 1.3763498374377e-11 2.360589374176776e-10 ] ] } "relaxed-potential-energy" { "source-value" -7.4672787 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.196389945270589e-18 } }