{ "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" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0900209 0.6645307 1.771827 ] [ 2.257627 0.9336486 1.950206 ] [ 2.208369 3.070111 3.037465 ] [ 1.738494 0.324563 4.412062 ] [ 4.235476 0.6031948 3.631674 ] [ 3.30736 2.214082 5.333714 ] [ 4.556657 2.857436 3.382282 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.002090000000001e-12 6.645307e-11 1.771827e-10 ] [ 2.257627e-10 9.336486e-11 1.950206e-10 ] [ 2.208369e-10 3.070111e-10 3.037465e-10 ] [ 1.738494e-10 3.24563e-11 4.412062e-10 ] [ 4.235476000000001e-10 6.031948e-11 3.631674e-10 ] [ 3.30736e-10 2.214082e-10 5.333714e-10 ] [ 4.556657000000001e-10 2.857436e-10 3.382282e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.775931 -0.8097254 -1.586463 ] [ -1.4795351 -0.587908 -7.1437959 ] [ -7.1403818 11.2154427 -7.3951237 ] [ -6.3095666 -7.2210368 7.0088952 ] [ 12.3602954 -13.2327367 -2.5809076 ] [ -2.4016567 3.1698555 15.5225227 ] [ 8.746776 7.4661088 -3.8251277 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.049708369953965e-09 -1.297323105147928e-09 -2.54179392836423e-09 ] [ -2.370476546872991e-09 -9.419324527812863e-10 -1.144562277474689e-08 ] [ -1.144015278354582e-08 1.796912008586203e-08 -1.184829430006399e-08 ] [ -1.010904009390054e-08 -1.156937633889644e-08 1.122948802707734e-08 ] [ 1.980337631606178e-08 -2.120118136994215e-08 -4.135069817165039e-09 ] [ -3.84787821592768e-09 5.078668373414295e-09 2.486982296577729e-08 ] [ 1.401388001457454e-08 1.196202496770914e-08 -6.128530172514476e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -3.3985765 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.445119812300292e-19 } "relaxed-configuration-positions" { "source-value" [ [ -0.5373702 1.1567437 2.2629864 ] [ 1.7854429 0.846378 2.066626 ] [ 2.8661507 2.9761532 1.9357158 ] [ 2.648252 -0.0252519 4.1160643 ] [ 5.0265698 0.6484836 3.753203 ] [ 2.4255573 2.0728898 5.4540529 ] [ 4.1794014 2.9921699 3.9305816 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.373702000000001e-11 1.1567437e-10 2.2629864e-10 ] [ 1.7854429e-10 8.46378e-11 2.066626e-10 ] [ 2.8661507e-10 2.9761532e-10 1.9357158e-10 ] [ 2.648252e-10 -2.52519e-12 4.1160643e-10 ] [ 5.0265698e-10 6.484836000000001e-11 3.753203e-10 ] [ 2.4255573e-10 2.0728898e-10 5.4540529e-10 ] [ 4.1794014e-10 2.9921699e-10 3.9305816e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.66e-05 8.9e-06 5e-06 ] [ -3.8e-06 -1.83e-05 -8.1e-06 ] [ 2.7e-06 5.6e-06 -2.4e-06 ] [ -3.88e-05 -5.11e-05 2e-07 ] [ 2.59e-05 2.12e-05 9.4e-06 ] [ 4e-07 -2.2e-06 -6.5e-06 ] [ 3.02e-05 3.6e-05 2.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.659613190528e-14 1.425937192512e-14 8.010883104e-15 ] [ -6.08827115904e-15 -2.931983216064e-14 -1.297763062848e-14 ] [ 4.32587687616e-15 8.972189076479999e-15 -3.84522388992e-15 ] [ -6.216445288704e-14 -8.187122532288001e-14 3.2043532416e-16 ] [ 4.149637447872e-14 3.396614436096001e-14 1.506046023552e-14 ] [ 6.408706483200001e-16 -3.52478856576e-15 -1.04141480352e-14 ] [ 4.838573394816e-14 5.76783583488e-14 3.84522388992e-15 ] ] } "relaxed-potential-energy" { "source-value" -15.300946 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.451481795732328e-18 } }