{ "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" [ 5.40884 0 0 ] "si-unit" "m" "si-value" [ 5.40884e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0760511 5.4684 0 ] "si-unit" "m" "si-value" [ 7.60511e-12 5.4684e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0640574 0.226818 5.41063 ] "si-unit" "m" "si-value" [ 6.40574e-12 2.26818e-11 5.41063e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00830896 0.0131794 0.144184 ] [ 1.38941 1.30499 1.31845 ] [ 0.000666759 2.66681 2.72971 ] [ 1.38566 4.09949 4.22322 ] [ 2.74889 -0.0321093 2.66684 ] [ 4.05308 1.21875 4.179 ] [ 2.6535 2.74282 -0.0977168 ] [ 4.21539 3.9917 1.44444 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -8.308960000000001e-13 1.31794e-12 1.44184e-11 ] [ 1.38941e-10 1.30499e-10 1.31845e-10 ] [ 6.667589999999999e-14 2.66681e-10 2.72971e-10 ] [ 1.38566e-10 4.099490000000001e-10 4.223220000000001e-10 ] [ 2.74889e-10 -3.21093e-12 2.66684e-10 ] [ 4.05308e-10 1.21875e-10 4.179e-10 ] [ 2.6535e-10 2.74282e-10 -9.771680000000001e-12 ] [ 4.21539e-10 3.9917e-10 1.44444e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.6324431 -8.26489 0.6981133 ] [ 1.515173 4.2733029 1.8237176 ] [ 5.0030728 -4.4228084 5.8202234 ] [ -13.2416755 12.5539884 -13.0952658 ] [ -1.3578778 -2.2775992 2.3262929 ] [ -3.8143016 7.1283702 -4.4803903 ] [ 14.9353377 -12.5655836 12.9424557 ] [ -5.6721716 3.5752197 -6.0351467 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.217638790406276e-09 -1.324181353148371e-08 1.118500807929537e-09 ] [ 2.427574757067399e-09 6.84658599997684e-09 2.921917701661486e-09 ] [ 8.015806272320394e-09 -7.086120216757855e-09 9.325025859313086e-09 ] [ -2.121550290632015e-08 2.01137067122744e-08 -2.098092870792181e-08 ] [ -2.175560065063339e-09 -3.649116189792783e-09 3.727132097513032e-09 ] [ -6.111184848200033e-09 1.142090807884742e-08 -7.178376590719098e-09 ] [ 2.392904888669284e-08 -2.01322842706279e-08 2.07360999382797e-08 ] [ -9.087820726685729e-09 5.72813341756359e-09 -9.669370945838273e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -32.184977 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.156601769038573e-18 } }