{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.051005 1.466214 2.567615 ] [ 0.3372835 2.721373 0.2523551 ] [ 2.822669 2.541764 0.4147021 ] [ 2.595922 2.673872 2.566842 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.051005e-10 1.466214e-10 2.567615e-10 ] [ 3.372835e-11 2.721373e-10 2.523551e-11 ] [ 2.822669e-10 2.541764e-10 4.147021e-11 ] [ 2.595922e-10 2.673872e-10 2.566842e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.1252599 -1.8170818 -1.13727 ] [ 1.8739233 -1.0284764 1.5643259 ] [ -1.0511873 0.3510067 -1.3309933 ] [ 3.3025239 2.4945515 0.9039374 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.609394966503745e-09 -2.911285978041181e-09 -1.822107405537216e-09 ] [ 3.002356100432385e-09 -1.647800843124549e-09 2.506326384291919e-09 ] [ -1.684187716141876e-09 5.623747284841593e-10 -2.132486347701441e-09 ] [ 5.291226582213237e-09 3.996712092681571e-09 1.448267368946738e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.9600427 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.946864452109709e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.6884803 1.7712476 2.5473935 ] [ 0.5483384 2.2688496 0.3417764 ] [ 2.7149717 2.9303211 0.3533557 ] [ 2.8550891 2.4328046 2.5589886 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.884803000000001e-11 1.7712476e-10 2.5473935e-10 ] [ 5.483384e-11 2.2688496e-10 3.417764e-11 ] [ 2.7149717e-10 2.9303211e-10 3.533557e-11 ] [ 2.8550891e-10 2.4328046e-10 2.5589886e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.75e-05 1.26e-05 1.7e-06 ] [ -5.4e-06 -2.31e-05 1.27e-05 ] [ 1.83e-05 3.22e-05 -3.33e-05 ] [ 4.5e-06 -2.16e-05 1.89e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.8038090864e-14 2.018742542208e-14 2.72370025536e-15 ] [ -8.65175375232e-15 -3.701027994048e-14 2.034764308416e-14 ] [ 2.931983216064e-14 5.159008718975999e-14 -5.335248147264001e-14 ] [ 7.2097947936e-15 -3.460701500928e-14 3.028113813312e-14 ] ] } "relaxed-potential-energy" { "source-value" -6.4872904 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.039378501122028e-18 } }