{ "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" [ [ 1.3347453 -4.3514599 0.9783625 ] [ 1.1737439 2.1525541 1.1154672 ] [ 2.7081173 -2.9996257 3.0199583 ] [ -12.9699676 11.5022207 -10.9931878 ] [ -0.0682108 -0.5270168 0.7963727 ] [ -2.577701 3.1684755 -2.960577 ] [ 13.2387835 -11.8893989 11.2420767 ] [ -2.8395105 2.944251 -3.1984727 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.138497714382682e-09 -6.971807318128706e-09 1.56750952416744e-09 ] [ 1.880545035386613e-09 3.448771854027186e-09 1.787175469109238e-09 ] [ 4.33888222444402e-09 -4.805930167690835e-09 4.838506584050912e-09 ] [ -2.078017886125349e-08 1.842858909282181e-08 -1.761302848122379e-08 ] [ -1.092857490460647e-10 -8.443739957288293e-10 1.275929721383372e-09 ] [ -4.129932277612781e-09 5.076457369677591e-09 -4.743367253478201e-09 ] [ 2.12108694115328e-08 -1.904891695294524e-08 1.801179245798042e-08 ] [ -4.549397337616119e-09 4.717210117967021e-09 -5.124518182207053e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -60.87102 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.752612512824922e-18 } }