{ "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" [ [ -1.6798768 -1.9122381 -0.8784254 ] [ 0.0733181 1.05432 1.1353716 ] [ -2.1375837 -2.943289 -2.7771697 ] [ 0.4676648 4.9793466 -0.8545484 ] [ -1.2817999 -2.1231383 -0.5012856 ] [ 0.1820672 1.4741456 2.9860785 ] [ 2.5851331 -4.2840058 -0.8712832 ] [ 1.7910772 3.754859 1.7612623 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.691459334784317e-09 -3.063743177223013e-09 -1.407392638996888e-09 ] [ 1.174685457014765e-10 1.689206854841856e-09 1.819065833440289e-09 ] [ -3.424786629143161e-09 -4.715668824057811e-09 -4.44951636533415e-09 ] [ 7.492816089311079e-10 7.97779270937997e-09 -1.369137467822047e-09 ] [ -2.053669832323778e-09 -3.401642546985057e-09 -8.031480686637005e-10 ] [ 2.917038112545178e-10 2.361841615975188e-09 4.784225160573534e-09 ] [ 4.141839814476229e-09 -6.863733936131601e-09 -1.395949573135811e-09 ] [ 2.869622015887926e-09 6.015947304200467e-09 2.821853280156436e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -32.653662 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.231693383990536e-18 } }