{ "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" [ [ 1.2336851 1.0731815 0.412321 ] [ -2.0561074 3.1156665 -3.8813705 ] [ -0.0227404 0.6070527 0.9947503 ] [ 0.5230145 -0.8854735 -1.1820606 ] [ 1.3061899 0.7074681 7.7763186 ] [ -2.9602671 0.5189821 -1.6635367 ] [ -1.4835954 -2.281987 -1.9411525 ] [ 3.4598209 -2.8548903 -0.5152696 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.976581440933953e-09 1.719426323341071e-09 6.606110719075139e-10 ] [ -3.294247233274491e-09 4.99184806563656e-09 -6.218641122996896e-09 ] [ -3.64341375278136e-11 9.726056515466117e-10 1.59376568732449e-09 ] [ 8.37961611143193e-10 -1.418684951726199e-09 -1.89386987329202e-09 ] [ 2.092746937346796e-09 1.133488859120375e-09 1.245903595945959e-08 ] [ -4.742870778018941e-09 8.315009940842513e-10 -2.665279630541468e-09 ] [ -2.376981884189884e-09 -3.656146250491758e-09 -3.110069178530685e-09 ] [ 5.54324420380485e-09 -4.57403853129325e-09 -8.255529133305264e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -35.72672 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.724051599346048e-18 } }