{ "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" [ 5.39006 0 0 ] "si-unit" "m" "si-value" [ 5.39006e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.23331 5.36322 0 ] "si-unit" "m" "si-value" [ 2.3331e-11 5.36322e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.160148 -0.0213292 5.4933 ] "si-unit" "m" "si-value" [ -1.60148e-11 -2.13292e-12 5.4933e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.105355 0.0424721 -0.0304949 ] [ 1.33629 1.36991 1.45967 ] [ -0.05353 2.71357 2.83859 ] [ 1.26119 4.17265 4.20892 ] [ 2.69817 -0.0783338 2.63037 ] [ 3.99124 1.24872 4.05842 ] [ 2.76699 2.61469 0.0747626 ] [ 4.02836 3.96527 1.47431 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.05355e-11 4.24721e-12 -3.04949e-12 ] [ 1.33629e-10 1.36991e-10 1.45967e-10 ] [ -5.353e-12 2.71357e-10 2.83859e-10 ] [ 1.26119e-10 4.17265e-10 4.20892e-10 ] [ 2.69817e-10 -7.83338e-12 2.63037e-10 ] [ 3.99124e-10 1.24872e-10 4.05842e-10 ] [ 2.76699e-10 2.61469e-10 7.47626e-12 ] [ 4.02836e-10 3.96527e-10 1.47431e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.490249 1.1247458 4.418913 ] [ 0.0836712 0.1720926 -0.7556434 ] [ 0.7914512 -0.3201966 0.4315346 ] [ 4.5456967 -3.855125 -3.5402927 ] [ -3.8466014 2.1446331 4.3449674 ] [ -0.5382726 0.9888036 0.767137 ] [ -0.6178167 0.5250391 -1.2954308 ] [ 4.0721206 -0.7799925 -4.3711851 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.194171969370581e-09 1.802041425102993e-09 7.07987909794919e-09 ] [ 1.34056040474281e-10 2.757227403326861e-10 -1.210674189141823e-09 ] [ 1.268044609144105e-09 -5.130115065796493e-10 6.913946471862797e-10 ] [ 7.283008977987712e-09 -6.1765911452616e-09 -5.672174194728909e-09 ] [ -6.16293483261655e-09 3.436081013013829e-09 6.961405186418162e-09 ] [ -8.624077753372301e-10 1.584238010482875e-09 1.229088966350649e-09 ] [ -9.898514726798073e-10 8.412053710258733e-10 -2.075508941624241e-09 ] [ 6.524256422398068e-09 -1.249685747899344e-09 -7.00341057240931e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.643368 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.550479427537086e-18 } }