{ "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" [ 5.23298 0 0 ] "si-unit" "m" "si-value" [ 5.23298e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.924429 5.53043 0 ] "si-unit" "m" "si-value" [ -9.24429e-11 5.53043e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.629107 -0.473789 5.46851 ] "si-unit" "m" "si-value" [ -6.29107e-11 -4.73789e-11 5.46851e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.204863 0.0604192 -0.0594365 ] [ 1.57212 1.62558 1.26329 ] [ -0.456749 2.61396 2.82457 ] [ 0.563094 3.85296 4.15247 ] [ 2.57153 0.0726254 2.31215 ] [ 3.48703 1.34311 4.10214 ] [ 2.49706 2.93083 0.328276 ] [ 3.43659 4.115 1.72734 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.04863e-11 6.04192e-12 -5.94365e-12 ] [ 1.57212e-10 1.62558e-10 1.26329e-10 ] [ -4.56749e-11 2.61396e-10 2.82457e-10 ] [ 5.63094e-11 3.85296e-10 4.15247e-10 ] [ 2.57153e-10 7.262540000000001e-12 2.31215e-10 ] [ 3.48703e-10 1.34311e-10 4.102140000000001e-10 ] [ 2.49706e-10 2.93083e-10 3.28276e-11 ] [ 3.43659e-10 4.115e-10 1.72734e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.3587513 -1.1561685 -4.06307 ] [ -14.4387741 -6.2682482 10.9846098 ] [ 3.170692 -7.2831216 -10.2078356 ] [ -0.1066947 9.3660847 6.5949081 ] [ 1.3632262 -8.960795 4.60983 ] [ -1.684609 -1.3242681 9.9335162 ] [ 4.9871534 3.905872 -24.9407963 ] [ 4.3502548 11.7206448 7.0888379 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.779136187141607e-09 -1.852386140405405e-09 -6.509755762673856e-09 ] [ -2.313346629603256e-08 -1.004284071941168e-08 1.759928501017056e-08 ] [ 5.080008594157594e-09 -1.166884715396349e-08 -1.635475554728994e-08 ] [ -1.709437539032697e-10 1.500612193477258e-08 1.056620757414455e-08 ] [ 2.184129146502025e-09 -1.435677625278154e-08 7.385761851862463e-09 ] [ -2.699041154989267e-09 -2.121711389491237e-09 1.591524741797806e-08 ] [ 7.990300581823231e-09 6.257896802237338e-09 -3.995956073599515e-08 ] [ 6.969876535082981e-09 1.877854307926109e-08 1.135757035202097e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 5.2246301 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 8.370780198547966e-19 } }