{ "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" [ 5.36644 0 0 ] "si-unit" "m" "si-value" [ 5.366440000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.227231 5.37948 0 ] "si-unit" "m" "si-value" [ -2.27231e-11 5.379480000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0350261 -0.0899265 5.39939 ] "si-unit" "m" "si-value" [ -3.50261e-12 -8.992650000000001e-12 5.399390000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00104229 0.0077963 0.00224549 ] [ 1.32493 1.37357 1.36608 ] [ -0.0958533 2.66355 2.80902 ] [ 1.19786 4.07015 4.22336 ] [ 2.70129 0.113781 2.60003 ] [ 3.9906 1.45175 3.98519 ] [ 2.48193 2.86985 0.00162227 ] [ 4.00824 4.16333 1.43322 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.04229e-13 7.7963e-13 2.24549e-13 ] [ 1.32493e-10 1.37357e-10 1.36608e-10 ] [ -9.58533e-12 2.66355e-10 2.80902e-10 ] [ 1.19786e-10 4.07015e-10 4.22336e-10 ] [ 2.70129e-10 1.13781e-11 2.60003e-10 ] [ 3.9906e-10 1.45175e-10 3.98519e-10 ] [ 2.48193e-10 2.86985e-10 1.62227e-13 ] [ 4.00824e-10 4.16333e-10 1.43322e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.1476386 2.8274409 -0.7929792 ] [ -1.4786608 1.0981805 -0.4667491 ] [ 2.4028132 2.4387301 -2.2901811 ] [ -0.6582594 1.283762 -3.8900779 ] [ 0.3209244 -1.6499654 2.1490537 ] [ -2.2372072 -2.0589398 3.3192872 ] [ 3.7591808 -1.8398427 1.6500019 ] [ -2.2564296 -2.0993656 0.3216446 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.365431132476429e-10 4.530059706673711e-09 -1.270492735020687e-09 ] [ -2.369075763853425e-09 1.759479122518454e-09 -7.478144957994412e-10 ] [ 3.849731133189635e-09 3.907276350661246e-09 -3.669274615818027e-09 ] [ -1.054647821101836e-09 2.05681346307145e-09 -6.232591864470761e-09 ] [ 5.141775707242675e-10 -2.64353598900892e-09 3.443163594983737e-09 ] [ -3.584401071725429e-09 -3.298785211194628e-09 5.318084349560694e-09 ] [ 6.022871591120242e-09 -2.947752959889548e-09 2.643594468455579e-09 ] [ -3.615198751601096e-09 -3.363554482831765e-09 5.153314583265677e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -35.445458 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.678988412114834e-18 } }