{ "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" [ [ 0.438828 2.90963 1.106787 ] [ 1.47463 4.835343 1.863436 ] [ 2.314132 3.251036 2.795551 ] [ 3.696872 4.248886 0.9164855 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.38828e-11 2.90963e-10 1.106787e-10 ] [ 1.47463e-10 4.835343e-10 1.863436e-10 ] [ 2.314132e-10 3.251036e-10 2.795551e-10 ] [ 3.696872e-10 4.248886e-10 9.164855e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.1304015 -2.3936874 -2.2179338 ] [ -2.3713667 6.3910253 -1.1955357 ] [ 3.1928323 -4.3532426 4.8632727 ] [ 2.3089359 0.3559047 -1.4498032 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.01545613833855e-09 -3.835110021380211e-09 -3.553521710118829e-09 ] [ -3.799348317385687e-09 1.023955140296284e-08 -1.915459363652833e-09 ] [ 5.115481307340477e-09 -6.974663575853407e-09 7.79182188471009e-09 ] [ 3.69932314838376e-09 5.702221942707798e-10 -2.322840810938428e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.2846185 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.327342218230413e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.4963863 3.1557421 1.7475518 ] [ 1.3560263 5.1472493 0.989162 ] [ 2.6035294 2.4838403 2.3710399 ] [ 3.4685201 4.4580634 1.5745057 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.963863e-11 3.1557421e-10 1.7475518e-10 ] [ 1.3560263e-10 5.147249300000001e-10 9.89162e-11 ] [ 2.603529400000001e-10 2.4838403e-10 2.3710399e-10 ] [ 3.4685201e-10 4.458063400000001e-10 1.5745057e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.66e-05 -4.9e-06 2.49e-05 ] [ 7.6e-06 -4.2e-05 -4.6e-06 ] [ -3.17e-05 1.62e-05 -3.66e-05 ] [ 4.07e-05 3.07e-05 1.63e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.65961321244e-14 -7.850665506599998e-15 3.989419818659999e-14 ] [ 1.21765424184e-14 -6.729141862799998e-14 -7.370012516399999e-15 ] [ -5.078899929779999e-14 2.59552614708e-14 -5.86396648044e-14 ] [ 6.520858900379999e-14 4.91868226638e-14 2.61154791342e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.755713 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.883472868461004e-18 } }