{ "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" [ [ 0.2480343 0.1647489 -0.6167862 ] [ -0.2158695 1.7542776 -0.7657017 ] [ -0.6144478 0.1701908 0.5110733 ] [ 0.9934451 -0.6797522 -0.1969236 ] [ 0.1720247 0.762733 2.9587006 ] [ -1.3212834 0.0556551 -0.980824 ] [ -0.6425087 -1.6513692 -1.5287355 ] [ 1.3806054 -0.5764841 0.619197 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.973947566164935e-10 2.639568358825171e-10 -9.88200429672073e-10 ] [ -3.458610660437856e-10 2.810662557113134e-09 -1.226789362246816e-09 ] [ -9.844538998619943e-10 2.726757208352487e-10 8.188296927751046e-10 ] [ 1.591674513268318e-09 -1.089083082777366e-09 -3.155063880037709e-10 ] [ 2.756139525401338e-10 1.222032980512646e-09 4.740360929266932e-09 ] [ -2.116929372931135e-09 8.916930004828608e-11 -1.571453281919539e-09 ] [ -1.029412417800601e-09 -2.645785124549199e-09 -2.449304277486998e-09 ] [ 2.211973694430232e-09 -9.236293472829294e-10 9.920629570694975e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -217.74719 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.488694570628956e-17 } }