{ "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" [ [ 2.146483 1.678803 1.689789 ] [ 0.9939717 3.024801 3.865516 ] [ 2.198915 3.863733 1.927968 ] [ 4.22715 2.33689 1.172014 ] [ 3.633184 2.755923 3.714191 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.146483e-10 1.678803e-10 1.689789e-10 ] [ 9.939717000000001e-11 3.024801e-10 3.865516e-10 ] [ 2.198915e-10 3.863733e-10 1.927968e-10 ] [ 4.22715e-10 2.33689e-10 1.172014e-10 ] [ 3.633184e-10 2.755923e-10 3.714191e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.015766 -5.5765374 -0.5339019 ] [ -0.2946539 -0.4129197 0.5851669 ] [ -0.7492849 5.8615527 -0.7449082 ] [ 3.015266 0.1720162 -0.9835364 ] [ 1.0444388 -0.0441119 1.6771796 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.831789779003533e-09 -8.934597847296819e-09 -8.554051419806996e-10 ] [ -4.720875898075411e-10 -6.615702896077498e-10 9.375407264460117e-10 ] [ -1.200486749098466e-09 9.391242697527116e-09 -1.193474502682211e-09 ] [ 4.830988690693133e-09 2.75600334038857e-10 -1.575799025785797e-09 ] [ 1.673375427216407e-09 -7.067505487906753e-11 2.687137944002696e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.3788748 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.342443731317028e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.8417808 1.1213401 1.7663485 ] [ 1.3471486 2.9156751 3.5141921 ] [ 2.2372401 4.4425783 1.671486 ] [ 3.9327333 2.5483832 1.4335999 ] [ 3.840801 2.6321732 3.9838515 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8417808e-10 1.1213401e-10 1.7663485e-10 ] [ 1.3471486e-10 2.9156751e-10 3.5141921e-10 ] [ 2.2372401e-10 4.4425783e-10 1.671486e-10 ] [ 3.9327333e-10 2.5483832e-10 1.4335999e-10 ] [ 3.840801e-10 2.6321732e-10 3.9838515e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.1e-06 2e-06 7.5e-06 ] [ 2.2e-06 7.1e-06 -7.6e-06 ] [ 1e-06 -9.1e-06 3.1e-06 ] [ -6.2e-06 8.3e-06 -7e-07 ] [ -3.1e-06 -8.3e-06 -2.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.77327738688e-15 3.2043532416e-15 1.2016324656e-14 ] [ 3.52478856576e-15 1.137545400768e-14 -1.217654231808e-14 ] [ 1.6021766208e-15 -1.457980724928e-14 4.96674752448e-15 ] [ -9.93349504896e-15 1.329806595264e-14 -1.12152363456e-15 ] [ -4.96674752448e-15 -1.329806595264e-14 -3.68500622784e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.212408 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.796425796047089e-18 } }