{ "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" [ [ -1.9416311 -1.8225217 -0.4849145 ] [ -0.035908 0.9000546 1.1342377 ] [ -1.5713288 -1.9601188 -2.3858432 ] [ 1.0345173 4.4899587 -1.1933021 ] [ -1.6203853 -2.5387693 0.0602274 ] [ -0.3297021 1.736371 3.1747598 ] [ 2.4763379 -3.856776 -1.4625737 ] [ 1.9881001 3.0518015 1.1574086 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.110835980267717e-09 -2.920001682697957e-09 -7.769186813877929e-10 ] [ -5.7530958573672e-11 1.442046449444216e-09 1.817249140341901e-09 ] [ -2.517546287691259e-09 -3.140456541224119e-09 -3.822542227427789e-09 ] [ 1.657479445528768e-09 7.193706916765015e-09 -1.911880741923131e-09 ] [ -2.59614346573708e-09 -4.067556851576536e-09 9.649493300657158e-11 ] [ -5.282410008007313e-10 2.781973044155214e-09 5.086525970122512e-09 ] [ 3.967530721268628e-09 -6.179236389771983e-09 -2.343301407642926e-09 ] [ 3.185287526273063e-09 4.88952505490615e-09 1.854373014910652e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.220786 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.642992036031431e-18 } }