{ "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" [ [ -0.9610805 -1.1061371 -0.497206 ] [ 0.0188922 0.5437659 0.7160847 ] [ -1.3957988 -1.4256902 -1.8832635 ] [ 0.0752384 2.9958896 -0.6530187 ] [ -0.7480853 -1.33705 -0.3427424 ] [ 0.2228938 0.844514 1.5834118 ] [ 1.5170778 -2.3499974 -0.1185611 ] [ 1.2708624 1.8347053 1.1952952 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.539820707806774e-09 -1.772227001019512e-09 -7.966118289214848e-10 ] [ 3.026864115547777e-11 8.712090121682708e-10 1.147294164852582e-09 ] [ -2.236316204700695e-09 -2.284207506943676e-09 -3.01732075050598e-09 ] [ 1.205452054663987e-10 4.799944275617864e-09 -1.046251294085209e-09 ] [ -1.198564778024154e-09 -2.14219025084064e-09 -5.491338602368819e-10 ] [ 3.571152352812711e-10 1.353060586738291e-09 2.536905367058846e-09 ] [ 2.430626583094699e-09 -3.765110893220786e-09 -1.899558225563309e-10 ] [ 2.036146025533778e-09 2.939521937717851e-09 1.91507402439446e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -16.923007240654236 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.711364655460534e-18 } }