{ "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" [ [ 1.152391 0.2084818 1.476287 ] [ 0.2004725 1.985654 1.37487 ] [ 0.8976264 2.29727 2.845471 ] [ 1.752289 1.001076 2.997864 ] [ 1.785348 1.533822 0.3428561 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.152391e-10 2.084818e-11 1.476287e-10 ] [ 2.004725e-11 1.985654e-10 1.37487e-10 ] [ 8.976264000000001e-11 2.29727e-10 2.845471e-10 ] [ 1.752289e-10 1.001076e-10 2.997864e-10 ] [ 1.785348e-10 1.533822e-10 3.428561e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.5580132 -28.9331319 -6.5849346 ] [ -27.1535219 8.2626582 -20.9997605 ] [ -9.9468807 38.9742432 24.1573217 ] [ 27.6285877 -25.3872199 22.1757627 ] [ 14.0298282 7.0834503 -18.7483893 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.302742186337795e-09 -4.635598749670269e-08 -1.0550228265617e-08 ] [ -4.35047379605608e-08 1.323823779370141e-08 -3.364532531549932e-08 ] [ -1.593665970742674e-08 6.244362126841337e-08 3.870429604888451e-08 ] [ 4.426587727866245e-08 -4.067481019088851e-08 3.552948854634869e-08 ] [ 2.247826273588055e-08 1.134893846525875e-08 -3.003823101411688e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 13.31275 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.13293768085552e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.0511008 -0.3773231 0.9278015 ] [ -0.3175885 1.5986783 1.5941705 ] [ 1.2641525 3.187844 2.6871302 ] [ 1.655792 0.7538855 3.0671135 ] [ 2.1346701 1.8632191 0.7611325 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0511008e-10 -3.773231e-11 9.278015e-11 ] [ -3.175885e-11 1.5986783e-10 1.5941705e-10 ] [ 1.2641525e-10 3.187844e-10 2.6871302e-10 ] [ 1.655792e-10 7.538855e-11 3.0671135e-10 ] [ 2.1346701e-10 1.8632191e-10 7.611325e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.2e-06 2.21e-05 1.67e-05 ] [ -1.73e-05 -2.13e-05 -3.08e-05 ] [ -4e-07 5.45e-05 4.32e-05 ] [ 1.48e-05 -2.86e-05 2.9e-06 ] [ 6.1e-06 -2.66e-05 -3.2e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.126965186560001e-15 3.540810331968e-14 2.675634956736e-14 ] [ -2.771765553984e-14 -3.412636202304e-14 -4.934703992064001e-14 ] [ -6.408706483200001e-16 8.731862583360001e-14 6.921403001856e-14 ] [ 2.371221398784e-14 -4.582225135488e-14 4.646312200320001e-15 ] [ 9.77327738688e-15 -4.261789811328e-14 -5.12696518656e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.840953 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.538000454779163e-18 } }