{ "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" [ 5.45804 0 0 ] "si-unit" "m" "si-value" [ 5.45804e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0357167 5.39587 0 ] "si-unit" "m" "si-value" [ -3.57167e-12 5.395870000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.019829 -0.0610013 5.23355 ] "si-unit" "m" "si-value" [ 1.9829e-12 -6.10013e-12 5.23355e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0872055 -0.452445 -0.0713075 ] [ 1.44372 1.30265 0.852604 ] [ 0.0844836 2.96191 2.59679 ] [ 1.14061 3.90928 3.87091 ] [ 2.7873 -0.319613 3.1468 ] [ 4.07117 1.23968 4.05459 ] [ 2.72619 2.52806 0.379157 ] [ 3.92833 3.98172 1.55502 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.720550000000001e-12 -4.52445e-11 -7.13075e-12 ] [ 1.44372e-10 1.30265e-10 8.526040000000001e-11 ] [ 8.44836e-12 2.96191e-10 2.59679e-10 ] [ 1.14061e-10 3.90928e-10 3.87091e-10 ] [ 2.7873e-10 -3.19613e-11 3.1468e-10 ] [ 4.071170000000001e-10 1.23968e-10 4.05459e-10 ] [ 2.72619e-10 2.52806e-10 3.79157e-11 ] [ 3.92833e-10 3.98172e-10 1.55502e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.9466466 10.4864798 7.5221282 ] [ -9.352636 -6.5416526 11.8729838 ] [ -4.5184246 -13.4963787 -8.181542 ] [ 8.4831964 -2.2903287 5.3455886 ] [ 1.0531355 3.3964633 -7.1019597 ] [ 4.0342235 1.4403155 0.4959085 ] [ 6.0869683 6.2308845 -9.7666334 ] [ 1.1601836 0.774217 -0.1864739 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.112975477547981e-08 1.680119277005146e-08 1.205177794070039e-08 ] [ -1.498457474205243e-08 -1.048088285711553e-08 1.902261706349714e-08 ] [ -7.239314256967593e-09 -2.16235824186031e-08 -1.310827531449327e-08 ] [ 1.359157894173473e-08 -3.669511097087257e-09 8.564577079335003e-09 ] [ 1.687309076634519e-09 5.441734092665217e-09 -1.137859379320378e-08 ] [ 6.46353857478195e-09 2.307639820675863e-09 7.945330047559968e-10 ] [ 9.75239830181072e-09 9.9829774728051e-09 -1.564787169740442e-08 ] [ 1.858819039755579e-09 1.240432376825914e-09 -2.987641229693972e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -20.254259 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.245090024142799e-18 } }