{ "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" [ [ 2.581885 1.428418 2.998356 ] [ 2.14644 1.796808 5.429666 ] [ 2.773837 4.089142 2.091611 ] [ 4.654129 1.242937 4.425266 ] [ 3.536635 3.29537 4.044312 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.581885000000001e-10 1.428418e-10 2.998356e-10 ] [ 2.14644e-10 1.796808e-10 5.429666e-10 ] [ 2.773837e-10 4.089142e-10 2.091611e-10 ] [ 4.654129e-10 1.242937e-10 4.425266e-10 ] [ 3.536635e-10 3.29537e-10 4.044312e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.3547225 -3.548321 -3.8148719 ] [ -3.0185679 0.1034437 2.3611613 ] [ -1.4720284 0.6979602 -3.4379784 ] [ 3.7377102 -2.3550371 -0.3604309 ] [ 3.1076086 5.1019543 5.2521198 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.772681337971728e-09 -5.685036949293677e-09 -6.112098569526875e-09 ] [ -4.836278917677352e-09 1.65735077709049e-10 3.782997432797735e-09 ] [ -2.358449487633631e-09 1.118255514688892e-09 -5.508248615295391e-09 ] [ 5.988471897765692e-09 -3.773185382736632e-09 -5.774739613939028e-10 ] [ 4.978937845517019e-09 8.17423189985003e-09 8.414823553200772e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -8.954088 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.434603045418583e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6392044 1.4435779 3.1334825 ] [ 1.5205965 2.0619962 5.444532 ] [ 2.7432109 3.8445464 2.0383989 ] [ 5.151948 1.205062 3.9105954 ] [ 3.6379661 3.2974925 4.4622022 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6392044e-10 1.4435779e-10 3.1334825e-10 ] [ 1.5205965e-10 2.0619962e-10 5.444532e-10 ] [ 2.7432109e-10 3.8445464e-10 2.0383989e-10 ] [ 5.151948e-10 1.205062e-10 3.9105954e-10 ] [ 3.6379661e-10 3.2974925e-10 4.4622022e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2e-06 3.2e-06 2.5e-06 ] [ 2.3e-06 1.4e-06 -1.7e-06 ] [ 8e-07 -1e-06 3.1e-06 ] [ -2e-06 2.2e-06 3e-07 ] [ -3e-06 -5.8e-06 -4.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.2043532416e-15 5.126965186560001e-15 4.005441552e-15 ] [ 3.68500622784e-15 2.24304726912e-15 -2.72370025536e-15 ] [ 1.28174129664e-15 -1.6021766208e-15 4.96674752448e-15 ] [ -3.2043532416e-15 3.52478856576e-15 4.8065298624e-16 ] [ -4.8065298624e-15 -9.292624400640001e-15 -6.72914180736e-15 ] ] } "relaxed-potential-energy" { "source-value" -12.793383 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.049725914354017e-18 } }