{ "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" [ [ 2.000595 3.042383 1.797674 ] [ 1.826337 5.433854 1.209578 ] [ 3.662908 4.706413 0.0276768 ] [ 4.382961 3.15094 1.702274 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.000595e-10 3.042383e-10 1.797674e-10 ] [ 1.826337e-10 5.433854e-10 1.209578e-10 ] [ 3.662908e-10 4.706413e-10 2.76768e-12 ] [ 4.382961e-10 3.15094e-10 1.702274e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.2146934 1.382809 -0.0382995 ] [ 0.0819258 -1.8938766 0.739995 ] [ 0.9165883 -0.0581602 -0.3414281 ] [ -1.2132075 0.5692278 -0.3602673 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.439767461200627e-10 2.215504250831827e-09 -6.136256348832961e-11 ] [ 1.312596014003366e-10 -3.034324811200193e-09 1.185602688508896e-09 ] [ 1.468536345158817e-09 -9.318291270105217e-11 -5.470281195041645e-10 ] [ -1.943772692679216e-09 9.120034730694182e-10 -5.772118452987399e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -11.333573 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.815838569073012e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0240184 3.197959 2.1701031 ] [ 1.7515009 5.1421613 0.9699416 ] [ 3.9121119 4.968392 0.1978412 ] [ 4.1851699 3.0250778 1.399317 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0240184e-10 3.197959e-10 2.1701031e-10 ] [ 1.7515009e-10 5.1421613e-10 9.699416e-11 ] [ 3.9121119e-10 4.968392e-10 1.978412e-11 ] [ 4.1851699e-10 3.0250778e-10 1.399317e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.9e-06 1.6e-06 -4e-07 ] [ 2.4e-06 -4.6e-06 2.2e-06 ] [ 1.4e-06 1.4e-06 -1.6e-06 ] [ -1.9e-06 1.7e-06 -3e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.04413557952e-15 2.56348259328e-15 -6.408706483200001e-16 ] [ 3.84522388992e-15 -7.370012455680001e-15 3.52478856576e-15 ] [ 2.24304726912e-15 2.24304726912e-15 -2.56348259328e-15 ] [ -3.04413557952e-15 2.72370025536e-15 -4.8065298624e-16 ] ] } "relaxed-potential-energy" { "source-value" -11.85629 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.899587064742483e-18 } }