{ "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" [ [ -0.3326566 0.1805661 -0.4500895 ] [ 0.6179396 -0.8759185 -0.4680635 ] [ -1.0822169 0.9114148 0.6003971 ] [ -1.6736482 2.1788739 -1.3402456 ] [ -0.5213266 -0.4413762 -0.1440158 ] [ 2.1591544 -1.2638163 -0.544995 ] [ 0.0801844 -0.8022918 1.325279 ] [ 0.7525699 0.112548 1.0217332 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.329746316658844e-10 2.892987863125074e-10 -7.211228801087429e-10 ] [ 9.900483883433063e-10 -1.403376153988329e-09 -7.499204029282589e-10 ] [ -1.733902630099914e-09 1.460247496441783e-09 9.619422047413614e-10 ] [ -2.681480039576158e-09 3.490940851012452e-09 -2.14731018414131e-09 ] [ -8.352572972026643e-10 -7.071626344437107e-10 -2.307387496868172e-10 ] [ 3.459346728878289e-09 -2.024856945528334e-09 -8.731782546468299e-10 ] [ 1.284695720913096e-10 -1.285413175609801e-09 2.123331047330886e-09 ] [ 1.205749909231716e-09 1.80321775803432e-10 1.636997059222048e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.281085 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.812870664316788e-18 } }