{ "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" [ 5.46497 0 0 ] "si-unit" "m" "si-value" [ 5.46497e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00264453 5.45437 0 ] "si-unit" "m" "si-value" [ 2.64453e-13 5.45437e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.00434361 0.134648 5.52148 ] "si-unit" "m" "si-value" [ -4.343610000000001e-13 1.34648e-11 5.521480000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.000601708 -0.00129581 -0.00103934 ] [ 1.36071 1.38338 1.29931 ] [ 0.0379757 2.81246 2.65752 ] [ 1.43056 4.2109 3.80234 ] [ 2.71672 0.059655 2.71923 ] [ 4.18219 1.40754 3.91392 ] [ 2.71688 2.7266 0.0375018 ] [ 4.08381 4.07468 1.29537 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.017079999999999e-14 -1.29581e-13 -1.03934e-13 ] [ 1.36071e-10 1.38338e-10 1.29931e-10 ] [ 3.79757e-12 2.812460000000001e-10 2.65752e-10 ] [ 1.43056e-10 4.2109e-10 3.80234e-10 ] [ 2.71672e-10 5.9655e-12 2.71923e-10 ] [ 4.18219e-10 1.40754e-10 3.91392e-10 ] [ 2.71688e-10 2.7266e-10 3.75018e-12 ] [ 4.08381e-10 4.07468e-10 1.29537e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.3519554 -0.2942017 -1.6596486 ] [ -0.178424 -0.028281 0.3707219 ] [ -0.1951453 -0.5596803 -0.8795253 ] [ -1.5453108 -1.3186544 4.2849963 ] [ 1.7729019 1.0620256 -2.4065482 ] [ -0.7536653 0.4624337 2.3388987 ] [ 0.5171574 -0.1196019 -2.4726206 ] [ 0.0305307 0.7959601 0.4237258 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.638947134443122e-10 -4.713630855396154e-10 -2.659050185663451e-09 ] [ -2.858667613896192e-10 -4.53111570128448e-11 5.939619609985555e-10 ] [ -3.126572373190022e-10 -8.967066917823303e-10 -1.409154873062106e-09 ] [ -2.475860835629745e-09 -2.112717250595051e-09 6.865320892074504e-09 ] [ 2.840501975151899e-09 1.701552587011092e-09 -3.855715262868322e-09 ] [ -1.207504923568218e-09 7.40900462810041e-10 3.747328815559513e-09 ] [ 8.285774955537138e-10 -1.916233679832595e-10 -3.961574917428468e-09 ] [ 4.891557375665856e-11 1.27526866330963e-09 6.788835703897766e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -35.55918 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.697208685081894e-18 } }