{ "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" [ [ -2.2621004 0.302854 -0.5359064 ] [ 1.0425274 1.8836113 0.7289856 ] [ 1.4991822 -0.7668664 0.2294176 ] [ -0.592949 0.0541392 -2.3633261 ] [ -0.0320044 -0.4797777 -0.7410202 ] [ 1.6162722 -0.2026997 -1.1743169 ] [ -0.4191414 -1.0236071 2.68188 ] [ -0.8517865 0.2323464 1.1742864 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.624284404642053e-09 4.852256023134359e-10 -8.586167120910575e-10 ] [ 1.670313040584771e-09 3.017878012398364e-09 1.16796369484247e-09 ] [ 2.401954690948715e-09 -1.228655427479697e-09 3.675675181483583e-10 ] [ -9.500090329536659e-10 8.674056122345278e-11 -3.786465855942348e-09 ] [ -5.12767018651896e-11 -7.686886204542618e-10 -1.187245249762007e-09 ] [ 2.589553553023775e-09 -3.247607230588098e-10 -1.881463098091314e-09 ] [ -6.715385574220475e-10 -1.639999378016501e-09 4.29684547119192e-09 ] [ -1.364712427456641e-09 3.722599730740175e-10 1.881414231703978e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.01415 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.770102962337109e-18 } }