{ "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" [ 5.37283 0 0 ] "si-unit" "m" "si-value" [ 5.372830000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.256601 5.36059 0 ] "si-unit" "m" "si-value" [ -2.56601e-11 5.36059e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0433697 -0.246629 5.47376 ] "si-unit" "m" "si-value" [ 4.33697e-12 -2.46629e-11 5.473760000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.00270324 -0.00280673 0.144383 ] [ 1.34461 1.35881 1.37149 ] [ -0.0221547 2.59799 2.84643 ] [ 1.34697 4.04373 4.10747 ] [ 2.75027 0.00909757 2.6523 ] [ 4.11164 1.31842 4.20835 ] [ 2.66226 2.78619 -0.017694 ] [ 3.99298 4.09333 1.38778 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.70324e-13 -2.80673e-13 1.44383e-11 ] [ 1.34461e-10 1.35881e-10 1.37149e-10 ] [ -2.21547e-12 2.59799e-10 2.84643e-10 ] [ 1.34697e-10 4.04373e-10 4.10747e-10 ] [ 2.75027e-10 9.09757e-13 2.6523e-10 ] [ 4.11164e-10 1.31842e-10 4.20835e-10 ] [ 2.66226e-10 2.78619e-10 -1.7694e-12 ] [ 3.99298e-10 4.09333e-10 1.38778e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 23.6053828 29.6843025 -37.0833868 ] [ 2.2308746 4.2150769 1.6619162 ] [ 4.7458699 10.6896175 -11.3162477 ] [ -5.3627221 -6.1954229 9.1413354 ] [ 8.5143529 5.8976573 -1.8890281 ] [ 0.3930081 -19.825516 0.9626325 ] [ -8.7421864 8.4755084 7.0009969 ] [ -25.3845799 -32.9412237 31.5217816 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.781999275878549e-08 4.755949586208778e-08 -5.941413584054402e-08 ] [ 3.574255157504096e-09 6.753297719693153e-09 2.66268330330607e-09 ] [ 7.603721861783915e-09 1.712665538489749e-08 -1.813062764949624e-08 ] [ -8.59202804325541e-09 -9.926161808128518e-09 1.464603398143704e-08 ] [ 1.364149727001014e-08 9.449088721399527e-09 -3.026556682789415e-09 ] [ 6.296683947927354e-10 -3.176397849219314e-08 1.542307298629005e-09 ] [ -1.400652678015257e-08 1.357926151975072e-08 1.121683364788643e-08 ] [ -4.067058077968605e-08 -5.277765890750702e-08 5.050346194157113e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -29.380548 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.707282749971543e-18 } }