{ "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" [ [ -0.8368442 -0.2155035 0.2690093 ] [ 0.5902484 -0.5744658 -0.3992406 ] [ -0.1095951 -0.0173409 1.4167488 ] [ -1.1262643 -1.2902168 1.4366442 ] [ 1.0279757 1.7118575 -0.381313 ] [ -0.6078413 0.306122 -0.1445023 ] [ 0.2491145 -0.2429537 -1.196749 ] [ 0.8132064 0.3225011 -1.0005974 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.34077221249208e-09 -3.452746694005728e-10 4.310004112377735e-10 ] [ 9.456821869446068e-10 -9.203956742091686e-10 -6.396539553941646e-10 ] [ -1.755907069742381e-10 -2.778318456363072e-11 2.269881804906455e-09 ] [ -1.804474330301677e-09 -2.06715519272339e-09 2.301757749647919e-09 ] [ 1.646998633290515e-09 2.742698064641136e-09 -6.109307738071104e-10 ] [ -9.738691200166791e-10 4.904615115125377e-10 -2.315182067118279e-10 ] [ 3.991254278022816e-10 -3.892547380768569e-10 -1.917403268765779e-09 ] [ 1.302900281964933e-09 5.167037226022828e-10 -1.603133761113266e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.52076924065424 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.807136685580799e-18 } }