{ "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" [ [ -1.1693331 -1.1016606 -0.5864603 ] [ 0.0175052 0.440759 0.7450656 ] [ -1.6687584 -1.7114209 -2.1029681 ] [ 0.1076241 3.3936847 -0.7993483 ] [ -0.9265385 -1.2951636 -0.3949757 ] [ 0.386516 0.7142894 1.8952194 ] [ 1.7565166 -2.7049362 -0.1061286 ] [ 1.496468 2.2644483 1.349596 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.873478170182785e-09 -1.76505487191842e-09 -9.396129894286303e-10 ] [ 2.804642241349679e-11 7.061737710252059e-10 1.19372669511719e-09 ] [ -2.673645716271225e-09 -2.74199857691925e-09 -3.369326351867375e-09 ] [ 1.724328182752794e-10 5.437282329503299e-09 -1.280697168687622e-09 ] [ -1.484478335201409e-09 -2.075080857127322e-09 -6.328208375377937e-10 ] [ 6.192669038671439e-10 1.144417786593879e-09 3.036476238983499e-09 ] [ 2.814249853753124e-09 -4.33378557610075e-09 -1.700367631191324e-10 ] [ 2.397606063128712e-09 3.628046155161022e-09 2.162291176539864e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.619734 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.706910552409535e-18 } }