{ "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" [ 5.4 0 0 ] "si-unit" "m" "si-value" [ 5.400000000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.386566 5.8038 0 ] "si-unit" "m" "si-value" [ 3.86566e-11 5.8038e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.433064 -0.220286 5.20849 ] "si-unit" "m" "si-value" [ -4.33064e-11 -2.20286e-11 5.20849e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0990081 -0.244555 -0.290689 ] [ 1.37678 1.31208 1.41317 ] [ 0.146167 2.66383 2.23753 ] [ 1.10278 3.83154 3.71513 ] [ 2.55958 0.422069 2.77183 ] [ 3.95966 1.45431 4.3569 ] [ 2.78855 2.68274 0.381413 ] [ 4.33575 3.68618 1.46711 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -9.90081e-12 -2.44555e-11 -2.90689e-11 ] [ 1.37678e-10 1.31208e-10 1.41317e-10 ] [ 1.46167e-11 2.66383e-10 2.23753e-10 ] [ 1.10278e-10 3.83154e-10 3.71513e-10 ] [ 2.55958e-10 4.22069e-11 2.77183e-10 ] [ 3.95966e-10 1.45431e-10 4.356900000000001e-10 ] [ 2.78855e-10 2.68274e-10 3.81413e-11 ] [ 4.33575e-10 3.68618e-10 1.46711e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.051175100000000015 -0.4873904000000001 0.23454620000000007 ] [ -0.16034480000000004 -1.2858147000000002 -0.7461626000000001 ] [ 0.12875570000000003 -0.47561540000000013 0.7184547000000001 ] [ 0.8776005000000002 0.7924161000000002 0.32916220000000007 ] [ 0.3469725000000001 -1.3450034000000002 0.4516253000000001 ] [ 0.27778590000000003 0.11679140000000003 -0.29919980000000007 ] [ -0.4725156000000001 0.5898296000000001 -0.4577271000000001 ] [ -0.9470791000000002 2.0947867000000002 -0.23069900000000004 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.19915487871021e-11 -7.808855040823606e-10 3.757844381374811e-10 ] [ -2.569006898268519e-10 -2.060102251020966e-09 -1.195484273035342e-09 ] [ 2.062893723347386e-10 -7.620198743724406e-10 1.151091323443878e-09 ] [ 1.406071003502391e-09 1.269590549365515e-09 5.273759812910939e-10 ] [ 5.559112275605282e-10 -2.154933002376511e-09 7.235834970217864e-10 ] [ 4.450620745678868e-10 1.871204505905012e-10 -4.793709245080359e-10 ] [ -7.570534472832847e-10 9.450111953758157e-10 -7.333596583265839e-10 ] [ -1.517387992068306e-09 3.356218276302784e-09 -3.696205442419393e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 31.306731 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.015891248187461e-18 } }