{ "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" [ [ 1.697876 3.711698 1.143091 ] [ 3.423522 2.241155 2.183353 ] [ 3.951754 3.941629 0.5726112 ] [ 3.96365 5.193256 2.218192 ] [ 5.084028 3.36384 3.521791 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.697876e-10 3.711698e-10 1.143091e-10 ] [ 3.423522e-10 2.241155e-10 2.183353e-10 ] [ 3.951754000000001e-10 3.941629e-10 5.726112e-11 ] [ 3.96365e-10 5.193256e-10 2.218192e-10 ] [ 5.084028e-10 3.36384e-10 3.521791e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.5409731 -0.0535651 0.519976 ] [ 0.054945 0.3182133 -0.038059 ] [ 0.1420696 -2.3888632 -3.0594807 ] [ 0.1300648 1.7059487 3.3163309 ] [ -0.8680524 0.4182663 -0.7387672 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.667344533017004e-10 -8.582075091081408e-11 8.330933905771008e-10 ] [ 8.8031594429856e-11 5.098339096876166e-10 -6.097724001102721e-11 ] [ 2.276205916464077e-10 -3.827380769329475e-09 -4.901828449328819e-09 ] [ 2.083867817490279e-10 2.733231123424153e-09 5.313347834816623e-09 ] [ -1.39077326090933e-09 6.70136487128519e-10 -1.183635536053878e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.6158527754089 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.395411401814933e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.001772 3.893895 1.4618531 ] [ 3.288418 2.0341138 2.1149 ] [ 4.2753998 3.7105943 0.7024829 ] [ 3.6342967 5.3363781 2.3533783 ] [ 4.9209434 3.4765968 3.0064239 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.001772e-10 3.893895e-10 1.4618531e-10 ] [ 3.288418e-10 2.0341138e-10 2.1149e-10 ] [ 4.2753998e-10 3.7105943e-10 7.024829000000001e-11 ] [ 3.6342967e-10 5.3363781e-10 2.3533783e-10 ] [ 4.9209434e-10 3.4765968e-10 3.0064239e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.36e-05 -1.6e-06 -2e-07 ] [ -1e-06 3.2e-06 -4.6e-06 ] [ 2.4e-06 -1e-07 -4.9e-06 ] [ 3.9e-06 -3.2e-06 -1.8e-06 ] [ 8.2e-06 1.7e-06 1.16e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.178960204288e-14 -2.56348259328e-15 -3.2043532416e-16 ] [ -1.6021766208e-15 5.126965186560001e-15 -7.370012455680001e-15 ] [ 3.84522388992e-15 -1.6021766208e-16 -7.850665441919999e-15 ] [ 6.24848882112e-15 -5.126965186560001e-15 -2.88391791744e-15 ] [ 1.313784829056e-14 2.72370025536e-15 1.858524880128e-14 ] ] } "relaxed-potential-energy" { "source-value" -5.786807775408899 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.271488126823796e-19 } }