{ "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" [ [ 2.599025 3.051266 5.123232 ] [ 1.56583 2.880417 3.388537 ] [ 2.27514 4.963397 2.856014 ] [ 3.509207 1.897473 3.301843 ] [ 3.336514 3.219201 1.422465 ] [ 4.208969 3.943636 3.692529 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.599025e-10 3.051266e-10 5.123232e-10 ] [ 1.56583e-10 2.880417e-10 3.388537e-10 ] [ 2.27514e-10 4.963397e-10 2.856014e-10 ] [ 3.509207e-10 1.897473e-10 3.301843e-10 ] [ 3.336514e-10 3.219201e-10 1.422465e-10 ] [ 4.208969e-10 3.943636e-10 3.692529e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.1667907 -0.4997373 9.8433042 ] [ -9.3647752 -2.7046723 -1.1079543 ] [ -3.2352138 8.3629761 -1.817194 ] [ 3.8671324 -9.1455156 -0.3697757 ] [ 1.6876282 -0.4390123 -8.8116017 ] [ 8.2120191 4.4259614 2.2632215 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.869404780906867e-09 -8.006674186017159e-10 1.577071186066245e-08 ] [ -1.500402388448764e-08 -4.333362725985364e-09 -1.77513847637483e-09 ] [ -5.183383913649527e-09 1.339896478772916e-08 -2.911465742258035e-09 ] [ 6.195829120818194e-09 -1.465273127948168e-08 -5.924459814799545e-10 ] [ 2.703878446642786e-09 -7.033752433036359e-10 -1.411774223554154e-08 ] [ 1.315710501158306e-08 7.091171879643238e-09 3.626080574991908e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 47.977567 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.686853617026559e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0923131 3.0784942 8.6835598 ] [ -1.8554847 1.5003636 2.6879868 ] [ 0.9861747 8.2769549 2.5285259 ] [ 4.8694724 -1.5113912 3.5663611 ] [ 3.8913535 3.2260727 -1.9673732 ] [ 7.510856 5.3848957 4.2855597 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0923131e-10 3.0784942e-10 8.6835598e-10 ] [ -1.8554847e-10 1.5003636e-10 2.6879868e-10 ] [ 9.861747e-11 8.2769549e-10 2.5285259e-10 ] [ 4.869472400000001e-10 -1.5113912e-10 3.5663611e-10 ] [ 3.8913535e-10 3.2260727e-10 -1.9673732e-10 ] [ 7.510856000000001e-10 5.3848957e-10 4.285559700000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0 -0.0 0.0 ] [ -0.0 -0.0 -0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 -0.0 0.0 ] [ -0.0 0.0 -0.0 ] [ 0.0 0.0 -0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" 3.1086245e-15 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.98056549674609e-34 } }