{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.39854e-10 0.0 0.0 ] "source-value" [ 5.39854 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.97648e-12 5.43736e-10 0.0 ] "source-value" [ 0.0197648 5.43736 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -2.99081e-12 -2.13673e-11 5.1785e-10 ] "source-value" [ -0.0299081 -0.213673 5.1785 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 2.929159059334516e-09 9.299271190569052e-09 -6.316954634656646e-10 ] [ -8.123064627070498e-09 7.049508077707644e-09 -1.740320518791655e-08 ] [ -3.991071790105707e-09 3.621093319606681e-09 6.702880530368467e-09 ] [ -2.157919139162358e-09 2.405044789208047e-09 -8.798676713018264e-09 ] [ 1.435320676348806e-08 -1.450974166238748e-08 1.430022662786209e-08 ] [ 3.657829627345004e-09 -3.665244660963729e-09 -4.481015958787388e-09 ] [ -2.289072996905722e-10 -2.467583991206692e-09 5.492400685250747e-09 ] [ -6.439232754356103e-09 -1.732347062533517e-09 4.819085479706562e-09 ] ] "source-value" [ [ 1.8282373 5.8041486 -0.3942733 ] [ -5.0700182 4.3999569 -10.8622264 ] [ -2.4910311 2.2601087 4.183609 ] [ -1.3468672 1.5011109 -5.4917021 ] [ 8.9585671 -9.0562685 8.9254995 ] [ 2.2830377 -2.2876658 -2.7968302 ] [ -0.1428727 -1.5401448 3.4280869 ] [ -4.019053 -1.081246 3.0078366 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.57946e-11 -2.85755e-11 3.780800000000001e-11 ] [ 1.35651e-10 1.53389e-10 1.4884e-10 ] [ 2.92057e-13 2.68505e-10 2.57873e-10 ] [ 1.38402e-10 4.097260000000001e-10 4.02157e-10 ] [ 2.45639e-10 4.43756e-11 2.59681e-10 ] [ 4.091370000000001e-10 1.38211e-10 4.21726e-10 ] [ 2.67291e-10 2.94824e-10 -1.6912e-11 ] [ 4.08439e-10 3.99712e-10 1.2513e-10 ] ] "source-value" [ [ 0.157946 -0.285755 0.37808 ] [ 1.35651 1.53389 1.4884 ] [ 0.00292057 2.68505 2.57873 ] [ 1.38402 4.09726 4.02157 ] [ 2.45639 0.443756 2.59681 ] [ 4.09137 1.38211 4.21726 ] [ 2.67291 2.94824 -0.16912 ] [ 4.08439 3.99712 1.2513 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -4.55203099554539e-18 "source-value" -28.411543 } }