{ "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" [ 5.47373 0 0 ] "si-unit" "m" "si-value" [ 5.47373e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.128217 5.8305 0 ] "si-unit" "m" "si-value" [ -1.28217e-11 5.8305e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.28854 -0.0943746 5.99929 ] "si-unit" "m" "si-value" [ 2.8854e-11 -9.437460000000001e-12 5.99929e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.153552 -0.151682 0.285368 ] [ 1.56659 1.11428 1.80298 ] [ 0.0114317 2.78427 2.63644 ] [ 1.58247 4.14354 3.67768 ] [ 2.87662 -0.0580046 2.88139 ] [ 4.22527 1.43863 4.17233 ] [ 2.56962 2.98931 0.105287 ] [ 4.06718 4.1162 1.17836 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.53552e-11 -1.51682e-11 2.85368e-11 ] [ 1.56659e-10 1.11428e-10 1.80298e-10 ] [ 1.14317e-12 2.78427e-10 2.63644e-10 ] [ 1.58247e-10 4.14354e-10 3.67768e-10 ] [ 2.87662e-10 -5.800460000000001e-12 2.88139e-10 ] [ 4.22527e-10 1.43863e-10 4.17233e-10 ] [ 2.56962e-10 2.98931e-10 1.05287e-11 ] [ 4.067179999999999e-10 4.1162e-10 1.17836e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.4929966 4.3787061 -3.7342943 ] [ -4.292919 3.8079826 -6.0682602 ] [ -0.288385 -0.617749 -0.0458172 ] [ -0.6100992 -2.4109219 5.6105355 ] [ 5.446926 -1.8090563 -0.5327825 ] [ -0.048011 -0.2421289 3.7226916 ] [ -2.2527445 -3.4498379 -4.3981017 ] [ -0.4477638 0.3430051 5.4460288 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.994220868253889e-09 7.015460542774346e-09 -5.982999022646702e-09 ] [ -6.878014456788116e-09 6.101060694133198e-09 -9.722424621371132e-09 ] [ -4.62043704789408e-10 -9.897430053225793e-10 -7.340724667051777e-11 ] [ -9.774866746087834e-10 -3.862722702754715e-09 8.989068808268439e-09 ] [ 8.726937492427662e-09 -2.898427709570951e-09 -8.536116654713762e-10 ] [ -7.692210174122879e-11 -3.879332628000212e-10 5.964409447968546e-09 ] [ -3.609294570535786e-09 -5.527249628929768e-09 -7.046535719640735e-09 ] [ -7.173966920005671e-10 5.495547520351661e-10 8.72550001956348e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -27.06331 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.336020256346285e-18 } }