{ "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" [ 5.33408 0 0 ] "si-unit" "m" "si-value" [ 5.33408e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.034982 5.4373 0 ] "si-unit" "m" "si-value" [ 3.4982e-12 5.437299999999999e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.179208 0.185424 5.40079 ] "si-unit" "m" "si-value" [ 1.79208e-11 1.85424e-11 5.40079e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0492126 -0.0420999 -0.0477888 ] [ 1.41891 1.35069 1.31795 ] [ 0.0600152 2.70621 2.67075 ] [ 1.52388 3.98641 4.19062 ] [ 2.7955 -0.0317733 2.51171 ] [ 4.14719 1.34284 3.96242 ] [ 2.77343 2.76788 -0.181612 ] [ 4.04692 4.12597 1.21449 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.92126e-12 -4.209990000000001e-12 -4.77888e-12 ] [ 1.41891e-10 1.35069e-10 1.31795e-10 ] [ 6.00152e-12 2.70621e-10 2.67075e-10 ] [ 1.52388e-10 3.98641e-10 4.19062e-10 ] [ 2.7955e-10 -3.17733e-12 2.51171e-10 ] [ 4.14719e-10 1.34284e-10 3.96242e-10 ] [ 2.77343e-10 2.76788e-10 -1.81612e-11 ] [ 4.04692e-10 4.12597e-10 1.21449e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.8643675 0.2623557 -0.188703 ] [ -0.3992811 0.3011981 -0.9560996 ] [ 0.7412716 0.9274169 -0.3211601 ] [ -2.7232445 2.707286 -3.4012643 ] [ -0.9393625 0.4047376 2.3237138 ] [ -0.9175552 0.1274866 -0.3266198 ] [ 1.8528035 -2.7894606 2.4007589 ] [ 0.5210007 -1.9410203 0.4693741 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.987046021079344e-09 4.203401688736186e-10 -3.023355348748224e-10 ] [ -6.397188435473068e-10 4.825725540493805e-10 -1.531840426276232e-09 ] [ 1.187648027183009e-09 1.485885674914812e-09 -5.145552037537901e-10 ] [ -4.363118670622186e-09 4.337550335019149e-09 -5.449426142621677e-09 ] [ -1.50502463595624e-09 6.48461120278702e-10 3.722999923790327e-09 ] [ -1.470085489733468e-09 2.042560499852813e-10 -5.233026074503719e-10 ] [ 2.968518450636413e-09 -4.469208557962741e-09 3.846439781757526e-09 ] [ 8.347351409604346e-10 -3.109857345158202e-09 7.520202094290413e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -16.62245824065424 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.663211397340052e-18 } }