{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.617948 3.024291 1.012928 ] [ 1.30973 1.622672 3.703727 ] [ 2.879916 3.04735 3.836046 ] [ 0.9226834 3.798669 3.025472 ] [ 3.183378 1.61886 2.358361 ] [ 3.567629 4.016165 2.010815 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.617948e-10 3.024291e-10 1.012928e-10 ] [ 1.30973e-10 1.622672e-10 3.703727e-10 ] [ 2.879916000000001e-10 3.04735e-10 3.836046e-10 ] [ 9.226834e-11 3.798669e-10 3.025472e-10 ] [ 3.183378e-10 1.61886e-10 2.358361e-10 ] [ 3.567629e-10 4.016165e-10 2.010815e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.4738183 -0.4870602 -10.4558691 ] [ -10.1009129 -10.7398635 3.555781 ] [ 10.4205456 8.9608625 21.2018417 ] [ -12.024846 9.3058249 1.5377141 ] [ 8.6756526 -15.386508 -9.0808944 ] [ 7.503379 8.3467444 -6.7585733 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.1678470859672e-09 -7.803564653621722e-10 -1.675214902216514e-08 ] [ -1.618344649711713e-08 -1.720715821028326e-08 5.696989186884845e-09 ] [ 1.669555453630031e-08 1.435688439970344e-08 3.396909508964253e-08 ] [ -1.92659271299204e-08 1.49095750920385e-08 2.463689580494513e-09 ] [ 1.389992776590273e-08 -2.465190339335217e-08 -1.454919670363364e-08 ] [ 1.202173841080168e-08 1.337295873747332e-08 -1.08284281312231e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 18.84146 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.018734671373837e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.9080721 3.3257078 0.8686535 ] [ 1.5228009 0.8587479 3.5112265 ] [ 3.6142544 3.8853155 4.2534233 ] [ 0.4118771 4.1629525 2.4610416 ] [ 2.9955441 0.6522622 2.3837164 ] [ 4.0287358 4.2430211 2.4692877 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.080721000000001e-11 3.3257078e-10 8.686535e-11 ] [ 1.5228009e-10 8.587479000000001e-11 3.5112265e-10 ] [ 3.6142544e-10 3.8853155e-10 4.2534233e-10 ] [ 4.118771e-11 4.1629525e-10 2.4610416e-10 ] [ 2.9955441e-10 6.522622e-11 2.3837164e-10 ] [ 4.0287358e-10 4.2430211e-10 2.4692877e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1e-07 1e-07 2e-07 ] [ -0.0 0.0 0.0 ] [ -0.0 -0.0 0.0 ] [ 1e-07 -1e-07 -2e-07 ] [ 0.0 -0.0 -0.0 ] [ 0.0 0.0 -0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.6021766208e-16 1.6021766208e-16 3.2043532416e-16 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 1.6021766208e-16 -1.6021766208e-16 -3.2043532416e-16 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" -32.352436 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.183431658512826e-18 } }