{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-periodic-cell-vector-1" { "source-unit" "angstrom" "source-value" [ 5.46402 0 0 ] "si-unit" "m" "si-value" [ 5.46402e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0122514 5.46447 0 ] "si-unit" "m" "si-value" [ 1.22514e-12 5.464470000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0384841 0.0769758 5.42124 ] "si-unit" "m" "si-value" [ -3.848410000000001e-12 7.69758e-12 5.42124e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.184284 -0.0140014 0.000758292 ] [ 1.32272 1.33713 1.35336 ] [ -0.167119 2.81332 2.70768 ] [ 1.35941 4.15239 4.11153 ] [ 2.7301 0.0328947 2.73301 ] [ 3.99842 1.37193 4.14824 ] [ 2.79546 2.80288 -0.167 ] [ 4.15007 4.1513 1.18971 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.84284e-11 -1.40014e-12 7.582920000000001e-14 ] [ 1.32272e-10 1.33713e-10 1.35336e-10 ] [ -1.67119e-11 2.81332e-10 2.70768e-10 ] [ 1.35941e-10 4.15239e-10 4.11153e-10 ] [ 2.7301e-10 3.28947e-12 2.73301e-10 ] [ 3.99842e-10 1.37193e-10 4.148240000000001e-10 ] [ 2.79546e-10 2.80288e-10 -1.67e-11 ] [ 4.150070000000001e-10 4.1513e-10 1.18971e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.4957821 0.3055457 -0.396901 ] [ 0.9427483 2.0511418 0.5212739 ] [ 1.2675546 -0.7515694 0.0054656 ] [ -0.5812508 -0.108248 -2.0022813 ] [ 0.0640522 -0.5001491 -0.7755811 ] [ 1.3214967 0.0430489 -1.0134284 ] [ -0.8619139 -1.1568241 2.4992703 ] [ -0.6569048 0.1170542 1.1621821 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.396507110431128e-09 4.895381771259705e-10 -6.359055029721408e-10 ] [ 1.510449285558945e-09 3.28629143790563e-09 8.35172855613237e-10 ] [ 2.030846345707496e-09 -1.204146921588684e-09 8.756856538644481e-12 ] [ -9.312664425812965e-10 -1.734324148483584e-10 -3.208008287125031e-09 ] [ 1.026229373508058e-10 -8.013271949341613e-10 -1.242617905954347e-09 ] [ 2.117271117204351e-09 6.897194113115711e-11 -1.623691289334751e-09 ] [ -1.380938299722549e-09 -1.853436527398001e-09 4.004272443719802e-09 ] [ -1.0524775126513e-09 1.875415026064473e-10 1.862020989732248e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -41.34541 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.624264927939054e-18 } }