{ "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" [ 5.4726 0 0 ] "si-unit" "m" "si-value" [ 5.4726e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.038105 5.56078 0 ] "si-unit" "m" "si-value" [ 3.8105e-12 5.560780000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0300683 -0.0732695 5.55519 ] "si-unit" "m" "si-value" [ -3.00683e-12 -7.32695e-12 5.55519e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0119551 0.065874 -0.0174062 ] [ 1.35048 1.36142 1.35358 ] [ 0.0629681 2.82177 2.8468 ] [ 1.33242 4.00392 4.21267 ] [ 2.75302 -0.0155517 2.72 ] [ 4.0777 1.32793 4.00537 ] [ 2.56601 2.8685 0.00815077 ] [ 4.04738 3.99965 1.27482 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.19551e-12 6.587400000000001e-12 -1.74062e-12 ] [ 1.35048e-10 1.36142e-10 1.35358e-10 ] [ 6.296810000000001e-12 2.82177e-10 2.8468e-10 ] [ 1.33242e-10 4.00392e-10 4.21267e-10 ] [ 2.75302e-10 -1.55517e-12 2.72e-10 ] [ 4.0777e-10 1.32793e-10 4.00537e-10 ] [ 2.56601e-10 2.8685e-10 8.15077e-13 ] [ 4.047380000000001e-10 3.99965e-10 1.27482e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.8069149 -2.1500076 -0.9839204 ] [ 0.1025169 1.2075555 1.2490032 ] [ -2.3823909 -3.1971855 -2.9728192 ] [ 0.4872224 5.445519 -0.8867145 ] [ -1.3296358 -2.3272134 -0.5207898 ] [ 0.1769538 1.5517917 3.1995244 ] [ 2.861664 -4.5707403 -1.0358343 ] [ 1.8905845 4.0402805 1.9515506 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.89499680855517e-09 -3.444691911262318e-09 -1.576414261608184e-09 ] [ 1.642501804168915e-10 1.934717190418454e-09 2.001123726344387e-09 ] [ -3.817011001586671e-09 -5.122455860460758e-09 -4.762981420105359e-09 ] [ 7.80616338410066e-10 8.724683229922195e-09 -1.420673241224361e-09 ] [ -2.130311392938704e-09 -3.728606901092479e-09 -8.343972419111078e-10 ] [ 2.83511241321719e-10 2.486244382091488e-09 5.126203191359147e-09 ] [ 4.584891157385012e-09 -7.323133248408378e-09 -1.659589498482734e-09 ] [ 3.029050285546858e-09 6.473242958574134e-09 3.126728745628212e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.763123 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.569666293659476e-18 } }