{ "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" [ [ 1.4538363 0.6827433 -0.0511422 ] [ -14.9166097 -7.8906361 7.7178727 ] [ 3.1406045 -2.9447605 -5.2610832 ] [ 2.6331975 6.083274 1.0543518 ] [ 0.9479928 -5.808336 7.1075414 ] [ -1.1193791 -2.3486108 2.0814131 ] [ 5.8386133 7.3763861 -13.4870295 ] [ 2.0217443 4.8499401 0.8380758 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.329302530330375e-09 1.093875353267841e-09 -8.193883717627776e-11 ] [ -2.38990433229385e-08 -1.264219268266049e-08 1.236539520225057e-08 ] [ 5.031803105079274e-09 -4.718026426955319e-09 -8.42918450312365e-09 ] [ 4.218847472449008e-09 9.7464793807205e-09 1.689257804058398e-09 ] [ 1.51885190084673e-09 -9.305980144950989e-09 1.13875366624481e-08 ] [ -1.793443023832145e-09 -3.762889315118385e-09 3.334791407046852e-09 ] [ 9.354489727151937e-09 1.181827335541409e-08 -2.160860334893992e-08 ] [ 3.239191450695662e-09 7.770460640500415e-09 1.342745453218257e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -28.416251 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.552785300298462e-18 } }