{ "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" [ [ -3.6512888 -2.7362893 1.4727647 ] [ 4.4078758 -6.5774162 4.4051654 ] [ -7.6446114 3.8983342 -2.5060958 ] [ 0.5534267 4.6332827 -2.9173872 ] [ -3.5204412 6.9404696 3.517033 ] [ -2.4155393 -0.9174961 -6.2182799 ] [ 6.809469 1.3695479 1.7208847 ] [ 5.4611091 -6.6104328 0.5259151 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.850009551148887e-09 -4.384018744205198e-09 2.359629170279525e-09 ] [ 7.062195554150097e-09 -1.053818246091118e-08 7.05785301463708e-09 ] [ -1.224801766018116e-08 6.245819915305071e-09 -4.015208100245073e-09 ] [ 8.866873200664955e-10 7.4233372194971e-09 -4.674169565661173e-09 ] [ -5.640368585541098e-09 1.111985813049313e-08 5.634908047182087e-09 ] [ -3.870120593083598e-09 -1.469990801095179e-09 -9.962782677370562e-09 ] [ 1.090997203186236e-08 2.194257626445736e-09 2.757161233432422e-09 ] [ 8.74966132365813e-09 -1.059108088552948e-08 8.42608877745694e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -16.627692 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.664049938026319e-18 } }