{ "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" [ 5.23298 0 0 ] "si-unit" "m" "si-value" [ 5.23298e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.924429 5.53043 0 ] "si-unit" "m" "si-value" [ -9.24429e-11 5.53043e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.629107 -0.473789 5.46851 ] "si-unit" "m" "si-value" [ -6.29107e-11 -4.73789e-11 5.46851e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.204863 0.0604192 -0.0594365 ] [ 1.57212 1.62558 1.26329 ] [ -0.456749 2.61396 2.82457 ] [ 0.563094 3.85296 4.15247 ] [ 2.57153 0.0726254 2.31215 ] [ 3.48703 1.34311 4.10214 ] [ 2.49706 2.93083 0.328276 ] [ 3.43659 4.115 1.72734 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.04863e-11 6.04192e-12 -5.94365e-12 ] [ 1.57212e-10 1.62558e-10 1.26329e-10 ] [ -4.56749e-11 2.61396e-10 2.82457e-10 ] [ 5.63094e-11 3.85296e-10 4.15247e-10 ] [ 2.57153e-10 7.262540000000001e-12 2.31215e-10 ] [ 3.48703e-10 1.34311e-10 4.102140000000001e-10 ] [ 2.49706e-10 2.93083e-10 3.28276e-11 ] [ 3.43659e-10 4.115e-10 1.72734e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.3387295 -0.4687894 0.2139593 ] [ -10.5325946 -4.8417404 5.2928032 ] [ 0.7374932 -2.5523547 -4.1334776 ] [ 0.7099838 3.9228505 2.6150781 ] [ 1.1776395 -3.7194226 4.9654199 ] [ -1.108652 -1.7215199 2.5580512 ] [ 5.483044 5.717119 -10.9302529 ] [ 2.1943566 3.6638576 -0.5815811 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.144881106475273e-09 -7.510834167588595e-10 3.428005882627334e-10 ] [ -1.687507682448433e-08 -7.75732327286284e-09 8.480005545535426e-09 ] [ 1.181594363038978e-09 -4.089323028328998e-09 -6.622561173320494e-09 ] [ 1.137519445506743e-09 6.28509935799359e-09 4.189816993386084e-09 ] [ 1.886786474630601e-09 -5.95917193259515e-09 7.955479676235073e-09 ] [ -1.776256315003162e-09 -2.758178936021954e-09 4.098449827449386e-09 ] [ 8.784804907617714e-09 9.159834400131476e-09 -1.75121956558114e-08 ] [ 3.515746842218177e-09 5.870146988660398e-09 -9.317956415191468e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -29.698471 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.75821959097068e-18 } }