{ "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" [ 5.42446 0 0 ] "si-unit" "m" "si-value" [ 5.42446e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.00225581 5.46076 0 ] "si-unit" "m" "si-value" [ -2.25581e-13 5.46076e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0117255 0.0343157 5.56103 ] "si-unit" "m" "si-value" [ -1.17255e-12 3.43157e-12 5.56103e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0182071 0.00139191 0.0164222 ] [ 1.32892 1.32964 1.49498 ] [ -0.00509802 2.67752 2.7579 ] [ 1.15566 4.0451 4.18086 ] [ 2.64397 0.106198 2.73506 ] [ 4.03699 1.34406 4.11378 ] [ 2.695 2.72586 0.109097 ] [ 4.00933 4.13019 1.43696 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.82071e-12 1.39191e-13 1.64222e-12 ] [ 1.32892e-10 1.32964e-10 1.49498e-10 ] [ -5.098020000000001e-13 2.67752e-10 2.7579e-10 ] [ 1.15566e-10 4.0451e-10 4.18086e-10 ] [ 2.64397e-10 1.06198e-11 2.73506e-10 ] [ 4.036990000000001e-10 1.34406e-10 4.11378e-10 ] [ 2.695e-10 2.72586e-10 1.09097e-11 ] [ 4.009330000000001e-10 4.13019e-10 1.43696e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.7758404 -0.0595626 0.1274886 ] [ -0.3364796 0.8320973 -1.8405456 ] [ -1.1137817 0.4347674 0.038001 ] [ 1.9621331 0.5872283 0.221575 ] [ 0.2428405 -2.1969038 1.5880173 ] [ -0.0784779 0.5602529 1.1785422 ] [ -0.4490866 -0.2777642 -1.1988068 ] [ 0.5486927 0.1198845 -0.1142717 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.24303335035212e-09 -9.542980519406208e-11 2.042592543385229e-10 ] [ -5.390997484961357e-10 1.333166840290804e-09 -2.948879129836309e-09 ] [ -1.78447500041488e-09 6.96574163766002e-10 6.08843137670208e-11 ] [ 3.143683779717829e-09 9.408434533321287e-10 3.5500228475376e-10 ] [ 3.890733716833823e-10 -3.519827906506679e-09 2.54428419148594e-09 ] [ -1.257354566294803e-10 8.976240981154005e-10 1.888232759466198e-09 ] [ -7.195160512345613e-10 -4.450273073352154e-10 -1.920700227816062e-09 ] [ 8.791026159436282e-10 1.920761430962976e-10 -1.830834461590714e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -17.484489038775916 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.801323956456064e-18 } }