{ "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" [ [ -0.6196991 -1.4017553 -0.6979343 ] [ 0.1854204 1.1257558 0.6526408 ] [ -1.0903193 -1.812567 -1.6210293 ] [ 0.1398213 2.6096318 -0.1905417 ] [ -0.8518127 -1.3221077 -0.4696787 ] [ 0.3288803 1.1080929 1.5330554 ] [ 1.011534 -2.3043179 -0.3584671 ] [ 0.8961751 1.9972674 1.1519548 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.928674099508013e-10 -2.24585956974249e-09 -1.118214018314413e-09 ] [ 2.970762298993844e-10 1.803659623490001e-09 1.045645831540209e-09 ] [ -1.746884091667021e-09 -2.904052471033594e-09 -2.59717524609179e-09 ] [ 2.240184179498631e-10 4.181091058856221e-09 -3.052814570274874e-10 ] [ -1.364754393240524e-09 -2.118250047119661e-09 -7.52508232427737e-10 ] [ 5.269243277016903e-10 1.775360538054472e-09 2.456225520271192e-09 ] [ 1.620656125944307e-09 -3.691924266270952e-09 -5.743276069459757e-10 ] [ 1.435830793363102e-09 3.199975133766002e-09 1.84563504877834e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.280671 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.812804286313656e-18 } }