{ "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" [ [ -0.2017401 0.1929274 -0.4089446 ] [ 0.3430043 -0.718701 -0.2971016 ] [ -0.7781211 0.743723 0.4229845 ] [ -1.2791302 1.5323465 -0.9577499 ] [ -0.3188554 -0.3145114 -0.1452125 ] [ 1.5500391 -0.957043 -0.4036691 ] [ 0.1303217 -0.5563429 0.9256812 ] [ 0.5544816 0.0776014 0.864012 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.232232743608234e-10 3.091037723383715e-10 -6.552014827204763e-10 ] [ 5.495534748215262e-10 -1.151485949032434e-09 -4.760092414440144e-10 ] [ -1.246687444842377e-09 1.191575612768382e-09 6.776958824441729e-10 ] [ -2.049392518283747e-09 2.455089757491681e-09 -1.534484510995837e-09 ] [ -5.108626715047236e-10 -5.039028162066276e-10 -2.32656074464725e-10 ] [ 2.483436427806389e-09 -1.533351932333262e-09 -6.467491998878093e-10 ] [ 2.087983826431578e-10 -8.913595948717986e-10 1.483104789173081e-09 ] [ 8.883774635029343e-10 1.243311498456876e-10 1.384299837895608e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.26454 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.810219863075835e-18 } }