{ "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" [ 5.48715 0 0 ] "si-unit" "m" "si-value" [ 5.48715e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0853536 5.45185 0 ] "si-unit" "m" "si-value" [ 8.53536e-12 5.45185e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0925937 0.0373061 5.50955 ] "si-unit" "m" "si-value" [ -9.25937e-12 3.73061e-12 5.50955e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.108625 -0.0346204 -0.093953 ] [ 1.31877 1.39109 1.34024 ] [ -0.0198257 2.75858 2.57664 ] [ 1.43337 4.133 3.94558 ] [ 2.6449 -0.0446732 2.70542 ] [ 4.12571 1.36749 4.0773 ] [ 2.7517 2.72879 0.0316261 ] [ 4.07324 4.11206 1.36119 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.08625e-11 -3.46204e-12 -9.3953e-12 ] [ 1.31877e-10 1.39109e-10 1.34024e-10 ] [ -1.98257e-12 2.75858e-10 2.57664e-10 ] [ 1.43337e-10 4.133e-10 3.94558e-10 ] [ 2.6449e-10 -4.467320000000001e-12 2.70542e-10 ] [ 4.12571e-10 1.36749e-10 4.0773e-10 ] [ 2.7517e-10 2.72879e-10 3.16261e-12 ] [ 4.07324e-10 4.11206e-10 1.36119e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.1863493 -0.0106788 0.3433991 ] [ 0.7650354 -0.5134766 -0.706155 ] [ -0.0858666 -0.1649249 1.8693043 ] [ -1.3546888 -1.4088851 1.6945631 ] [ 1.2471096 1.9279864 -0.3577244 ] [ -0.7111107 0.3768317 -0.1671073 ] [ 0.4393935 -0.3181411 -1.3729088 ] [ 0.8864769 0.1112884 -1.3033709 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.900741112562445e-09 -1.710932369819904e-11 5.501860096237613e-10 ] [ 1.225721831964377e-09 -8.226802038478731e-10 -1.131385031661024e-09 ] [ -1.375734590275853e-10 -2.642388189677779e-10 2.99495564662091e-09 ] [ -2.170450723819607e-09 -2.25728276861347e-09 2.714989381290372e-09 ] [ 1.99808984469524e-09 3.088974735300357e-09 -5.731376703697075e-10 ] [ -1.139324938340722e-09 6.037509397163193e-10 -2.677354092250118e-10 ] [ 7.039859930314849e-10 -5.097182325355949e-10 -2.199642381850583e-09 ] [ 1.420292564059259e-09 1.783036726462387e-10 -2.088230384211055e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.146994 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.791386869899788e-18 } }