{ "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" [ 5.21631 0 0 ] "si-unit" "m" "si-value" [ 5.21631e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.340777 5.491 0 ] "si-unit" "m" "si-value" [ 3.40777e-11 5.491e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0764414 0.261433 5.31631 ] "si-unit" "m" "si-value" [ 7.644140000000001e-12 2.61433e-11 5.31631e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.102562 0.0713388 -0.561849 ] [ 1.48031 1.58239 0.779774 ] [ 0.554166 2.97803 2.26105 ] [ 1.29704 4.12978 3.93608 ] [ 3.06699 -0.246774 2.56051 ] [ 4.28292 1.50929 4.5131 ] [ 2.82838 2.54855 -0.698649 ] [ 4.65405 4.12903 1.02077 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.02562e-11 7.133879999999999e-12 -5.61849e-11 ] [ 1.48031e-10 1.58239e-10 7.79774e-11 ] [ 5.541660000000001e-11 2.97803e-10 2.26105e-10 ] [ 1.29704e-10 4.12978e-10 3.93608e-10 ] [ 3.06699e-10 -2.46774e-11 2.56051e-10 ] [ 4.28292e-10 1.50929e-10 4.5131e-10 ] [ 2.82838e-10 2.54855e-10 -6.98649e-11 ] [ 4.65405e-10 4.12903e-10 1.02077e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 16.6525868 -19.1829429 7.3227407 ] [ 0.4407955 -3.963994 1.8930232 ] [ 0.3903799 -3.647219 1.5141387 ] [ 3.3263831 0.18247 -3.1887197 ] [ -2.1005392 2.0120058 1.0024439 ] [ -10.9946227 18.0203891 -9.0448535 ] [ -2.8417564 6.015137 2.9009863 ] [ -4.8732271 0.5641541 -2.3997596 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.668038524680269e-08 -3.073446263252135e-08 1.173232394972063e-08 ] [ 7.062322446538464e-10 -6.351018511791476e-09 3.032957513672003e-09 ] [ 6.25457549010242e-10 -5.843489012737556e-09 2.425917625788505e-09 ] [ 5.329453234644229e-09 2.92349167997376e-10 -5.108892153624389e-09 ] [ -3.365434797313936e-09 3.223588653674e-09 1.606092180243573e-09 ] [ -1.761532744445697e-08 2.887184611373915e-08 -1.449145281626105e-08 ] [ -4.552995666088774e-09 9.63731187230905e-09 4.647892427121095e-09 ] [ -7.807770527468985e-09 9.038745095484653e-10 -3.844838726660359e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -19.588697 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.13845523653351e-18 } }