{ "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" [ [ -0.8632238 -0.2704782 0.2035101 ] [ 0.5409668 -0.619996 -0.4060184 ] [ -0.2485558 -0.0312837 1.4222452 ] [ -1.1012633 -1.3763056 1.4597702 ] [ 1.1016437 1.8462508 -0.2656635 ] [ -0.5848141 0.3354489 -0.0437008 ] [ 0.2957588 -0.3216615 -1.2788193 ] [ 0.8594876 0.4380254 -1.0913235 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.383036990878135e-09 -4.333538484760665e-10 3.260591243166701e-10 ] [ 8.667243595889893e-10 -9.933430961895168e-10 -6.505131880946227e-10 ] [ -3.982302917242406e-10 -5.012201275212096e-11 2.278688008485021e-09 ] [ -1.764418312605057e-09 -2.205084655396117e-09 2.33880968618054e-09 ] [ 1.765027780591609e-09 2.958019867893296e-09 -4.256398486999008e-10 ] [ -9.369754785341933e-10 5.374483850530771e-10 -7.001640007025663e-11 ] [ 4.73857834755863e-10 -5.153585351114592e-10 -2.048894384687822e-09 ] [ 1.377050938587502e-09 7.017940551965684e-10 -1.748492997429629e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.580735038775916 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.816744265560615e-18 } }