{ "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" [ [ 1.442259 2.324158 2.548252 ] [ 2.158618 1.41899 4.605472 ] [ 2.34516 4.213318 2.000238 ] [ 2.029556 3.900131 4.500233 ] [ 3.591834 1.471441 2.657937 ] [ 4.338938 2.513725 4.512162 ] [ 5.128703 3.807673 2.402827 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.442259e-10 2.324158e-10 2.548252e-10 ] [ 2.158618e-10 1.41899e-10 4.605472e-10 ] [ 2.34516e-10 4.213318e-10 2.000238e-10 ] [ 2.029556e-10 3.900131e-10 4.500233e-10 ] [ 3.591834e-10 1.471441e-10 2.657937e-10 ] [ 4.338938e-10 2.513725e-10 4.512162e-10 ] [ 5.128703e-10 3.807673e-10 2.402827e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.8734776 -2.0374608 -1.7716458 ] [ -1.3515994 -2.0529602 3.4834738 ] [ 3.9854975 2.5036442 -0.0719089 ] [ 0.5936602 0.7958623 0.0194999 ] [ 2.7126594 -0.6708472 -3.8961557 ] [ 2.017484 2.5600978 1.7854467 ] [ -3.084224 -1.0983361 0.4512901 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.808171872712494e-09 -3.264372059556465e-09 -2.838489481098512e-09 ] [ -2.165500959367307e-09 -3.289204835872892e-09 5.581140281529335e-09 ] [ 6.385470916756848e-09 4.01128020404152e-09 -1.152107584074451e-10 ] [ 9.511484931394522e-10 1.275111970436116e-09 3.124228388793792e-11 ] [ 4.346159470873356e-09 -1.074815699969142e-09 -6.242329573536659e-09 ] [ 3.232365697638068e-09 4.101728842121514e-09 2.860600960424512e-09 ] [ -4.941471586110259e-09 -1.759728421200651e-09 7.230464474184941e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -20.832196 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.337685739112328e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.012514 2.3175418 2.6858829 ] [ 2.2242312 1.3315289 4.6682093 ] [ 2.5543574 3.9800586 1.5773434 ] [ 2.4480372 3.9196081 4.2119978 ] [ 3.5619814 1.6945188 2.4243195 ] [ 4.5149583 2.3846485 4.7848131 ] [ 4.7189886 4.0215314 2.8745551 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.012514e-10 2.3175418e-10 2.6858829e-10 ] [ 2.2242312e-10 1.3315289e-10 4.668209300000001e-10 ] [ 2.5543574e-10 3.9800586e-10 1.5773434e-10 ] [ 2.4480372e-10 3.9196081e-10 4.2119978e-10 ] [ 3.5619814e-10 1.6945188e-10 2.4243195e-10 ] [ 4.5149583e-10 2.3846485e-10 4.7848131e-10 ] [ 4.718988600000001e-10 4.0215314e-10 2.8745551e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.36e-05 3.9e-06 -4.1e-06 ] [ -7.5e-06 -5.2e-06 -1.1e-06 ] [ 3.7e-06 1.9e-06 -2.3e-06 ] [ 5.7e-06 -1.33e-05 5.3e-06 ] [ 5e-06 -9e-07 1.19e-05 ] [ 4.2e-06 9.5e-06 -4.1e-06 ] [ 2.4e-06 4.2e-06 -5.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.178960204288e-14 6.24848882112e-15 -6.568924145279999e-15 ] [ -1.2016324656e-14 -8.33131842816e-15 -1.76239428288e-15 ] [ 5.928053496960001e-15 3.04413557952e-15 -3.68500622784e-15 ] [ 9.13240673856e-15 -2.130894905664e-14 8.491536090240001e-15 ] [ 8.010883104e-15 -1.44195895872e-15 1.906590178752e-14 ] [ 6.72914180736e-15 1.52206778976e-14 -6.568924145279999e-15 ] [ 3.84522388992e-15 6.72914180736e-15 -9.13240673856e-15 ] ] } "relaxed-potential-energy" { "source-value" -24.454184 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.917992188554143e-18 } }