{ "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" [ 5.48581 0 0 ] "si-unit" "m" "si-value" [ 5.48581e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00228581 5.44331 0 ] "si-unit" "m" "si-value" [ 2.28581e-13 5.44331e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0206328 -0.0957916 5.42731 ] "si-unit" "m" "si-value" [ -2.06328e-12 -9.57916e-12 5.427310000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00584564 0.00126862 0.0177865 ] [ 1.36937 1.35462 1.37323 ] [ -0.0302415 2.74811 2.64947 ] [ 1.37836 4.07615 4.08107 ] [ 2.65918 -0.0413914 2.54007 ] [ 4.19104 1.29728 4.08084 ] [ 2.79028 2.80414 0.0605432 ] [ 4.08315 4.18517 1.33386 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.845640000000001e-13 1.26862e-13 1.77865e-12 ] [ 1.36937e-10 1.35462e-10 1.37323e-10 ] [ -3.02415e-12 2.74811e-10 2.64947e-10 ] [ 1.37836e-10 4.07615e-10 4.081070000000001e-10 ] [ 2.65918e-10 -4.13914e-12 2.54007e-10 ] [ 4.19104e-10 1.29728e-10 4.08084e-10 ] [ 2.79028e-10 2.80414e-10 6.05432e-12 ] [ 4.08315e-10 4.18517e-10 1.33386e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.4244943 0.4460187 -0.2150206 ] [ -0.4942648 1.0427318 -0.9025527 ] [ 0.0894429 -0.0200416 0.7600968 ] [ 0.1162552 -0.4834146 -0.5772466 ] [ 0.653888 0.5392031 2.6590492 ] [ -1.2028424 0.2947702 -0.809627 ] [ -0.3502425 -0.8975999 -0.918849 ] [ 0.7632693 -0.9216678 0.00415 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.801148431228615e-10 7.146007335796089e-10 -3.445009783103885e-10 ] [ -7.918995070443878e-10 1.670640511724701e-09 -1.446048834979916e-09 ] [ 1.433033232765524e-10 -3.211018296342528e-11 1.217809322504893e-09 ] [ 1.862613634864282e-10 -7.745155702733838e-10 -9.248510069562894e-10 ] [ 1.04764406622167e-09 8.638986006828845e-10 4.260266461796944e-09 ] [ -1.927165971786962e-09 4.722739229485401e-10 -1.297165450968442e-09 ] [ -5.611503451105441e-10 -1.438113574612418e-09 -1.472158385845459e-09 ] [ 1.222892227834382e-09 -1.47667460130417e-09 6.649032976320001e-12 ] ] } "unrelaxed-potential-energy" { "source-value" -17.594350038775918 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.818925629029835e-18 } }