{ "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" [ 5.59774 0 0 ] "si-unit" "m" "si-value" [ 5.597740000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.20689 5.51351 0 ] "si-unit" "m" "si-value" [ -2.0689e-11 5.513510000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.513105 0.215809 5.94806 ] "si-unit" "m" "si-value" [ 5.131050000000001e-11 2.15809e-11 5.94806e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00246673 -0.00144352 -0.0330248 ] [ 1.48237 1.24989 1.2555 ] [ 0.11896 2.3805 2.33914 ] [ 1.62926 4.22989 4.16904 ] [ 2.92639 0.137476 2.28463 ] [ 4.54625 1.57381 3.68026 ] [ 3.00188 2.71108 0.0736878 ] [ 4.22934 4.27512 1.23802 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -2.46673e-13 -1.44352e-13 -3.30248e-12 ] [ 1.48237e-10 1.24989e-10 1.2555e-10 ] [ 1.1896e-11 2.3805e-10 2.33914e-10 ] [ 1.62926e-10 4.22989e-10 4.16904e-10 ] [ 2.92639e-10 1.37476e-11 2.28463e-10 ] [ 4.54625e-10 1.57381e-10 3.68026e-10 ] [ 3.00188e-10 2.71108e-10 7.36878e-12 ] [ 4.22934e-10 4.27512e-10 1.23802e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.089796 -1.5331349 4.0835265 ] [ -1.6521245 -0.2031498 4.2534585 ] [ -2.2868832 -6.7630881 2.0350769 ] [ -0.2201954 0.1722702 -0.1017102 ] [ -2.3092135 1.31078 -3.9472356 ] [ 5.4156175 4.1377535 -8.0582364 ] [ 1.1284392 0.7578352 2.9011707 ] [ 1.0141558 2.1207341 -1.1660505 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.746045687026664e-09 -2.456352913549927e-09 6.5425307426198e-09 ] [ -2.646995270358933e-09 -3.254818627617732e-10 6.814791822388688e-09 ] [ -3.663990827727149e-09 -1.083566172750345e-08 3.260552657573154e-09 ] [ -3.527919247942836e-10 2.760072891745068e-10 -1.629577058794668e-10 ] [ -3.699767912617359e-09 2.10010108831452e-09 -6.32416864721297e-09 ] [ 8.676775817181493e-09 6.629411974951718e-09 -1.291071807132828e-08 ] [ 1.807958919129653e-09 1.214185849862717e-09 4.648187906785423e-09 ] [ 1.624856725995577e-09 3.397790621947019e-09 -1.868218865164017e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 5.041643398437522 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 8.077603249936949e-19 } }