{ "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" [ [ 0.4300208 0.5019362 -0.3209422 ] [ -0.5217961 1.1118356 -0.9961226 ] [ 0.0627252 -0.0444941 0.7784069 ] [ 0.0880386 -0.5116033 -0.5161994 ] [ 0.5963488 0.5152247 2.7733211 ] [ -1.1485584 0.3702182 -0.6868984 ] [ -0.3849772 -0.9160884 -1.0181438 ] [ 0.8781983 -1.027029 -0.0134216 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.889692778939871e-10 8.041904513987508e-10 -5.142060937045547e-10 ] [ -8.360095191323273e-10 1.78135701916937e-09 -1.595964354319328e-09 ] [ 1.004968498029768e-10 -7.12874073708594e-11 1.247145346924375e-09 ] [ 1.410533878100724e-10 -8.196788531372921e-10 -8.270426171648195e-10 ] [ 9.554561130739392e-10 8.254809755996598e-10 4.443350264999176e-09 ] [ -1.840193431264425e-09 5.931549495215388e-10 -1.100532566411985e-09 ] [ -6.168014744627448e-10 -1.467735429158446e-09 -1.631246206411969e-09 ] [ 1.407028796278522e-09 -1.645481866240386e-09 -2.15037739108944e-11 ] ] } "unrelaxed-potential-energy" { "source-value" -26.213474074190156 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.199861565763225e-18 } }