{ "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" [ 5.55154 0 0 ] "si-unit" "m" "si-value" [ 5.55154e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.061684 5.43974 0 ] "si-unit" "m" "si-value" [ 6.1684e-12 5.43974e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.265567 0.0876051 5.42724 ] "si-unit" "m" "si-value" [ 2.65567e-11 8.760510000000001e-12 5.427240000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0647023 0.102264 0.485367 ] [ 1.35693 1.92881 1.38138 ] [ 0.0777781 2.73495 2.46621 ] [ 1.63547 4.09153 3.75722 ] [ 2.82757 -0.0639025 2.36092 ] [ 4.37612 1.31575 3.25969 ] [ 2.62065 2.47384 -0.106223 ] [ 4.18903 3.98589 0.601522 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.470230000000001e-12 1.02264e-11 4.85367e-11 ] [ 1.35693e-10 1.92881e-10 1.38138e-10 ] [ 7.77781e-12 2.73495e-10 2.46621e-10 ] [ 1.63547e-10 4.09153e-10 3.75722e-10 ] [ 2.82757e-10 -6.390250000000001e-12 2.36092e-10 ] [ 4.37612e-10 1.31575e-10 3.25969e-10 ] [ 2.62065e-10 2.47384e-10 -1.06223e-11 ] [ 4.18903e-10 3.98589e-10 6.01522e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.6383408999999998 2.9591397999999995 -4.517234299999999 ] [ 5.408798899999999 -11.166176299999998 1.2696845999999997 ] [ -5.626061099999999 11.452784199999998 0.17017429999999997 ] [ -1.7961866999999998 -1.2356489999999998 2.9271515999999997 ] [ -0.7984359999999999 0.6982372999999998 -5.330446199999999 ] [ -1.4787064999999997 -3.4220867999999998 7.287253399999999 ] [ 2.5624643999999996 3.0905808999999995 -9.262577599999998 ] [ -1.9102139999999999 -2.3768301999999997 7.455994399999999 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.82926472848043e-09 4.741064605238788e-09 -7.237407186135853e-09 ] [ 8.665851144188756e-09 -1.789018661159104e-08 2.034258981909799e-09 ] [ -9.01394356161233e-09 1.834938308830763e-08 2.726492849210054e-10 ] [ -2.877808337331903e-09 -1.979727939314899e-09 4.689813859057313e-09 ] [ -1.279235492405069e-09 1.118699477830516e-09 -8.5403162800722e-09 ] [ -2.369148983324995e-09 -5.482787465308285e-09 1.167546702732531e-08 ] [ 4.105520553312299e-09 4.951656462671022e-09 -1.484028527906577e-08 ] [ -3.060500211524851e-09 -3.808101778051388e-09 1.194581991249572e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -23.793533 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.812144229883329e-18 } }