{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.46402e-10 0.0 0.0 ] "source-value" [ 5.46402 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.22514e-12 5.464470000000001e-10 0.0 ] "source-value" [ 0.0122514 5.46447 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -3.848410000000001e-12 7.69758e-12 5.42124e-10 ] "source-value" [ -0.0384841 0.0769758 5.42124 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -4.268223511766484e-09 3.979611260519462e-10 -8.188857689568326e-10 ] [ 2.224522582594986e-09 4.048197878173317e-09 1.373933423318749e-09 ] [ 2.53920272811541e-09 -1.766221241956443e-09 3.790376577660154e-10 ] [ -1.003566264771518e-09 2.425416625159181e-10 -4.783126868499975e-09 ] [ -2.977427353736372e-10 -9.937364305499233e-10 -1.430083144953644e-09 ] [ 3.290593923003126e-09 -1.331064303911328e-10 -2.379063732907492e-09 ] [ -1.217281885961326e-09 -2.366522054537532e-09 5.311239690818974e-09 ] [ -1.267504675622895e-09 5.70885490693849e-10 2.346948743414204e-09 ] ] "source-value" [ [ -2.6640156 0.2483878 -0.5111083 ] [ 1.3884378 2.5266864 0.8575418 ] [ 1.5848457 -1.1023886 0.2365767 ] [ -0.6263768 0.1513826 -2.985393 ] [ -0.1858364 -0.6202415 -0.8925877 ] [ 2.0538272 -0.0830785 -1.4848948 ] [ -0.7597676 -1.4770669 3.3150151 ] [ -0.7911142 0.3563187 1.4648502 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "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 ] ] "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 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.734625277013409e-18 "source-value" -35.792716 } }