{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.47373e-10 0.0 0.0 ] "source-value" [ 5.47373 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -1.28217e-11 5.8305e-10 0.0 ] "source-value" [ -0.128217 5.8305 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 2.8854e-11 -9.437460000000001e-12 5.99929e-10 ] "source-value" [ 0.28854 -0.0943746 5.99929 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 8.770219813185587e-09 1.184355506161967e-08 -3.070281019141849e-09 ] [ -2.13817652603551e-08 1.883956213608192e-08 -1.560641409559992e-08 ] [ 3.170395108122144e-10 -1.279115168940847e-09 -9.741690474800928e-10 ] [ -5.666468042693929e-09 -8.37541833964752e-09 1.131422362376289e-09 ] [ 2.579833430544146e-08 -8.707204123859916e-09 1.033521007483448e-08 ] [ -1.340323763255917e-09 7.665700559755123e-10 -3.404286619062363e-09 ] [ -5.344193579990913e-09 -6.824165620998351e-09 -3.768871041532141e-09 ] [ -1.152842822925736e-09 -6.263784000230467e-09 1.535738954582325e-08 ] ] "source-value" [ [ 5.4739407 7.3921657 -1.9163187 ] [ -13.3454483 11.7587299 -9.7407576 ] [ 0.1978805 -0.7983609 -0.6080285 ] [ -3.5367312 -5.227525 0.7061783 ] [ 16.1020539 -5.4346094 6.4507308 ] [ -0.8365643 0.4784554 -2.1247886 ] [ -3.3355833 -4.2593092 -2.3523443 ] [ -0.7195479 -3.9095465 9.5853287 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "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 ] ] "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 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -7.519238064617677e-18 "source-value" -46.931393 } }