{ "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" [ 5.51396 0 0 ] "si-unit" "m" "si-value" [ 5.51396e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0181329 5.46551 0 ] "si-unit" "m" "si-value" [ 1.81329e-12 5.46551e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.147171 -0.00272143 5.46493 ] "si-unit" "m" "si-value" [ 1.47171e-11 -2.72143e-13 5.46493e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0812176 -0.117418 -0.0378641 ] [ 1.41633 1.35692 1.32004 ] [ 0.0825096 2.73802 2.72856 ] [ 1.5042 4.09281 4.08646 ] [ 2.79856 -0.0135645 2.62504 ] [ 4.22175 1.43085 4.07963 ] [ 2.7526 2.68069 -0.168753 ] [ 4.2604 4.00574 1.18537 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -8.12176e-12 -1.17418e-11 -3.78641e-12 ] [ 1.41633e-10 1.35692e-10 1.32004e-10 ] [ 8.25096e-12 2.73802e-10 2.72856e-10 ] [ 1.5042e-10 4.09281e-10 4.08646e-10 ] [ 2.79856e-10 -1.35645e-12 2.62504e-10 ] [ 4.22175e-10 1.43085e-10 4.07963e-10 ] [ 2.7526e-10 2.68069e-10 -1.68753e-11 ] [ 4.2604e-10 4.00574e-10 1.18537e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.7177781 3.3080665 -0.9917325 ] [ -0.8022875 -0.5134991 -0.8464738 ] [ 0.3451224 0.3236957 -0.6076773 ] [ -0.0724308 -0.1345192 -1.1958974 ] [ 1.3935358 -0.1782468 0.3877881 ] [ 0.8228728 -3.0600402 -1.6003066 ] [ -0.8384397 1.2811872 2.5016548 ] [ -2.5661511 -1.0266442 2.3526447 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.752183911542245e-09 5.300106806351684e-09 -1.588930625587536e-09 ] [ -1.28540627566008e-09 -8.227162528218413e-10 -1.356200532479735e-09 ] [ 5.529470405943859e-10 5.186176827934906e-10 -9.736063630508677e-10 ] [ -1.160469343858406e-10 -2.155235172887194e-10 -1.916038855155506e-09 ] [ 2.232690479007825e-09 -2.855828556924135e-10 6.213050276444524e-10 ] [ 1.318387562052234e-09 -4.902724867148156e-09 -2.563973820631937e-09 ] [ -1.343328485290566e-09 2.052688178708214e-09 4.0080928338721e-09 ] [ -4.111427297860203e-09 -1.644865335119919e-09 3.769352335389029e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.166447 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.79450358408023e-18 } }