{ "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" [ [ -2.1328121 0.5170982 -0.7776604 ] [ -0.0333688 0.8521381 1.8898425 ] [ 1.6636937 -0.6711777 0.1371852 ] [ -0.823869 -0.1649508 -2.2408502 ] [ 0.1250404 -0.3579501 -0.8898794 ] [ 1.4224251 -0.4163257 -0.958432 ] [ 0.8144142 0.119857 1.4934299 ] [ -1.0355235 0.1213111 1.3463644 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.417141711332471e-09 8.284826535234587e-10 -1.245949322067093e-09 ] [ -5.346271166461919e-11 1.365275752761155e-09 3.027861495440145e-09 ] [ 2.665531172273006e-09 -1.075345228201862e-09 2.197949219706168e-10 ] [ -1.319983661276946e-09 -2.642803175196072e-10 -3.590237830734227e-09 ] [ 2.003368071860136e-10 -5.734992863579633e-10 -1.42574398175794e-09 ] [ 2.278976258835113e-09 -6.670273086736938e-10 -1.535577355677888e-09 ] [ 1.304835401637803e-09 1.92032084821338e-10 2.392738490296956e-09 ] [ -1.659091555657899e-09 1.943618098648374e-10 2.157113582529429e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.330155 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.500297218259826e-18 } }