{ "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" [ 5.05932 0 0 ] "si-unit" "m" "si-value" [ 5.059319999999999e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.224512 5.44129 0 ] "si-unit" "m" "si-value" [ 2.24512e-11 5.441290000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.327401 0.688972 5.24092 ] "si-unit" "m" "si-value" [ 3.27401e-11 6.88972e-11 5.24092e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.119472 0.0796179 0.152764 ] [ 1.48092 1.5486 0.772169 ] [ 0.0612704 2.84226 2.7863 ] [ 1.84412 4.4971 3.9905 ] [ 2.88701 0.305191 2.51679 ] [ 4.25223 1.88781 3.92663 ] [ 2.58737 2.78734 -0.624797 ] [ 3.988 4.24006 0.48768 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.19472e-11 7.96179e-12 1.52764e-11 ] [ 1.48092e-10 1.5486e-10 7.72169e-11 ] [ 6.127040000000001e-12 2.84226e-10 2.786300000000001e-10 ] [ 1.84412e-10 4.4971e-10 3.9905e-10 ] [ 2.88701e-10 3.05191e-11 2.51679e-10 ] [ 4.25223e-10 1.88781e-10 3.92663e-10 ] [ 2.58737e-10 2.78734e-10 -6.247970000000001e-11 ] [ 3.988e-10 4.24006e-10 4.8768e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 4.2202132 -0.3710275 -4.2312542 ] [ 0.0145307 1.7047861 9.3234874 ] [ 10.624192 3.0526879 -4.847758 ] [ -9.2299018 1.79783 -4.9959525 ] [ 0.4038663 1.7825352 -3.2951137 ] [ -4.4411146 -3.8763258 -2.7649467 ] [ 1.5070241 -2.0320412 4.2555946 ] [ -3.0988099 -2.0584447 6.555943 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.761526979538368e-09 -5.94451591071435e-10 -6.779216611754362e-09 ] [ 2.32807480156638e-11 2.731368455387987e-09 1.493787365967341e-08 ] [ 1.702183217752973e-08 4.890945224274528e-09 -7.766964594886571e-09 ] [ -1.478793299807454e-08 2.88044121790422e-09 -8.004398360073884e-09 ] [ 6.470651491200341e-10 2.855936246722516e-09 -5.279354176513285e-09 ] [ -7.115450041036256e-09 -6.210558622531357e-09 -4.429932996995407e-09 ] [ 2.414518799894879e-09 -3.255688929965321e-09 6.818214231896576e-09 ] [ -4.964840814987876e-09 -3.297992000721139e-09 1.050377868843586e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -23.375012 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.745089804586961e-18 } }