{ "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" [ 5.46402 0 0 ] "si-unit" "m" "si-value" [ 5.46402e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0122514 5.46447 0 ] "si-unit" "m" "si-value" [ 1.22514e-12 5.464470000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0384841 0.0769758 5.42124 ] "si-unit" "m" "si-value" [ -3.848410000000001e-12 7.69758e-12 5.42124e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.184284 -0.0140014 0.000758292 ] [ 1.32272 1.33713 1.35336 ] [ -0.167119 2.81332 2.70768 ] [ 1.35941 4.15239 4.11153 ] [ 2.7301 0.0328947 2.73301 ] [ 3.99842 1.37193 4.14824 ] [ 2.79546 2.80288 -0.167 ] [ 4.15007 4.1513 1.18971 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.84284e-11 -1.40014e-12 7.582920000000001e-14 ] [ 1.32272e-10 1.33713e-10 1.35336e-10 ] [ -1.67119e-11 2.81332e-10 2.70768e-10 ] [ 1.35941e-10 4.15239e-10 4.11153e-10 ] [ 2.7301e-10 3.28947e-12 2.73301e-10 ] [ 3.99842e-10 1.37193e-10 4.148240000000001e-10 ] [ 2.79546e-10 2.80288e-10 -1.67e-11 ] [ 4.150070000000001e-10 4.1513e-10 1.18971e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.3290205 0.1727327 -1.2954988 ] [ 1.5939671 2.964814 1.4711833 ] [ 1.946059 -0.9887803 0.4535539 ] [ -1.3642399 0.2979888 -3.350326 ] [ 0.03069 -0.6409249 -1.0254585 ] [ 2.3647905 -0.7480961 -1.2297294 ] [ -0.053675 -1.3804671 3.7439473 ] [ -1.1885714 0.3227328 1.2323282 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.333678815263926e-09 2.767482935876601e-10 -2.075617889634455e-09 ] [ 2.553816821944376e-09 4.750155675820531e-09 2.357095488171393e-09 ] [ 3.117930232497427e-09 -1.58420067976761e-09 7.266734548526612e-10 ] [ -2.18575327294253e-09 4.774306886202471e-10 -5.367813989258381e-09 ] [ 4.917080049235199e-11 -1.026874890468578e-09 -1.642965634300637e-09 ] [ 3.788812052189942e-09 -1.198582081531659e-09 -1.970243694590412e-09 ] [ -8.599683012144001e-11 -2.211752113403576e-09 5.998464833567283e-09 ] [ -1.904301309231525e-09 5.170749469253222e-10 1.974407431192547e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.696906 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.719274822809525e-18 } }