{ "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" [ 5.52208 0 0 ] "si-unit" "m" "si-value" [ 5.52208e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0968577 5.45697 0 ] "si-unit" "m" "si-value" [ -9.68577e-12 5.456970000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.137264 0.147448 5.57607 ] "si-unit" "m" "si-value" [ 1.37264e-11 1.47448e-11 5.57607e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0138032 0.0341723 -0.113332 ] [ 1.31844 1.45238 1.31404 ] [ 0.0088982 2.79356 2.65987 ] [ 1.44046 4.10222 4.12461 ] [ 2.80067 0.127474 2.69388 ] [ 4.04292 1.57371 4.10996 ] [ 2.66616 2.79739 -0.110182 ] [ 4.02446 4.16186 1.2374 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.38032e-12 3.41723e-12 -1.13332e-11 ] [ 1.31844e-10 1.45238e-10 1.31404e-10 ] [ 8.8982e-13 2.79356e-10 2.65987e-10 ] [ 1.44046e-10 4.10222e-10 4.12461e-10 ] [ 2.80067e-10 1.27474e-11 2.69388e-10 ] [ 4.04292e-10 1.57371e-10 4.10996e-10 ] [ 2.66616e-10 2.79739e-10 -1.10182e-11 ] [ 4.024460000000001e-10 4.16186e-10 1.2374e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.6074084 2.1967928 -4.2733616 ] [ 5.1920612 -3.7495066 -4.4419527 ] [ -4.8262756 5.6406474 3.6423093 ] [ -9.9198013 9.1338909 -8.4600111 ] [ -1.8815654 -1.5417437 -1.2381573 ] [ 6.614329 -3.9640257 -1.5062538 ] [ 3.4725788 -5.4860509 11.8489714 ] [ -0.258735 -2.2300041 4.4284559 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.575352158557535e-09 3.51965006490177e-09 -6.846680047744483e-09 ] [ 8.318599068402794e-09 -6.007371814055297e-09 -7.116792766639436e-09 ] [ -7.732545931857493e-09 9.037313390456305e-09 5.835622806182413e-09 ] [ -1.589327372584144e-08 1.463410645691787e-08 -1.355443199612849e-08 ] [ -3.0146000943862e-09 -2.470145711405689e-09 -1.983746678932852e-09 ] [ 1.059732328607944e-08 -6.351069300790355e-09 -2.413284623351159e-09 ] [ 5.563684567245719e-09 -8.7896224924988e-09 1.898414495760784e-08 ] [ -4.14539167982688e-10 -3.572860433308146e-09 7.095168509223823e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.801084 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.575748316329695e-18 } }