{ "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" [ [ 0.0755506 0.3541964 0.6731301 ] [ 0.5631114 0.1579036 2.39025 ] [ 0.1113923 2.692001 2.732528 ] [ 1.634511 1.700059 1.731597 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.555059999999999e-12 3.541964e-11 6.731301e-11 ] [ 5.631114000000001e-11 1.579036e-11 2.39025e-10 ] [ 1.113923e-11 2.692001e-10 2.732528e-10 ] [ 1.634511e-10 1.700059e-10 1.731597e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -225.5746367 34.5972214 -668.187503 ] [ 187.7866759 -102.0114849 633.1806268 ] [ -208.0579862 162.656127 137.2779138 ] [ 245.845947 -95.2418636 -102.2710376 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.614104091661937e-07 5.543085927172145e-08 -1.07055439561733e-06 ] [ 3.008674218247268e-07 -1.634404161598722e-07 1.01446719700245e-06 ] [ -3.333456412603691e-07 2.606038439092756e-07 2.199434640425577e-07 ] [ 3.938886286018359e-07 -1.525942871813425e-07 -1.638562654276777e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 357.93191 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.734701380402898e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.2079067 -0.1621406 -0.1329549 ] [ 0.0796084 -0.0428097 2.9886402 ] [ 0.1276612 3.0409223 3.5017625 ] [ 1.9693889 2.0681879 1.1700573 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.079067e-11 -1.621406e-11 -1.329549e-11 ] [ 7.96084e-12 -4.28097e-12 2.9886402e-10 ] [ 1.276612e-11 3.0409223e-10 3.5017625e-10 ] [ 1.9693889e-10 2.0681879e-10 1.1700573e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.8e-06 -5.6e-06 3.22e-05 ] [ -1.34e-05 -1.88e-05 -3.23e-05 ] [ 8.3e-06 1.44e-05 1.06e-05 ] [ -2.7e-06 1e-05 -1.05e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.249697764224e-14 -8.972189076479999e-15 5.159008718975999e-14 ] [ -2.146916671872e-14 -3.012092047104e-14 -5.175030485184e-14 ] [ 1.329806595264e-14 2.307134333952e-14 1.698307218048e-14 ] [ -4.32587687616e-15 1.6021766208e-14 -1.68228545184e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.4802817 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.358690907753808e-18 } }