{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.43079e-10 0.0 0.0 ] "source-value" [ 5.43079 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -8.397710000000001e-12 5.432970000000001e-10 0.0 ] "source-value" [ -0.0839771 5.43297 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 3.98452e-12 7.85902e-12 5.46584e-10 ] "source-value" [ 0.0398452 0.0785902 5.46584 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 6.065285692367355e-09 1.312647940547646e-08 4.209103034241302e-09 ] [ 3.537036565155368e-09 -4.918821134569024e-09 -4.242412286187735e-09 ] [ -7.51839564015046e-09 -3.949720572828831e-09 2.952007700123744e-09 ] [ -1.23272158140299e-09 -9.056447544967873e-09 1.489653353456285e-09 ] [ -5.936732327497212e-09 1.079778169682044e-08 -1.006044383394441e-08 ] [ 4.316319572181604e-09 1.121121199836387e-08 9.916324522114886e-10 ] [ 3.274950430695297e-09 -3.964898632828318e-09 5.776555681138704e-09 ] [ -2.505742711348962e-09 -1.32455853756844e-08 -1.116096101039378e-09 ] ] "source-value" [ [ 3.7856536 8.1929041 2.6271155 ] [ 2.2076446 -3.0700867 -2.6479055 ] [ -4.6926135 -2.4652217 1.8424983 ] [ -0.7694043 -5.65259 0.9297685 ] [ -3.7054169 6.7394453 -6.2792352 ] [ 2.6940348 6.9974882 0.6189283 ] [ 2.0440633 -2.4746951 3.6054425 ] [ -1.5639616 -8.2672442 -0.6966124 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -5.20054e-12 -8.17533e-12 4.07426e-12 ] [ 1.35344e-10 1.3045e-10 1.28849e-10 ] [ 8.197160000000001e-13 2.75378e-10 2.6961e-10 ] [ 1.33497e-10 4.09637e-10 3.90076e-10 ] [ 2.57675e-10 -3.01907e-12 2.72622e-10 ] [ 4.09447e-10 1.46101e-10 4.06258e-10 ] [ 2.656010000000001e-10 2.62697e-10 -1.16016e-11 ] [ 4.03834e-10 4.012660000000001e-10 1.20961e-10 ] ] "source-value" [ [ -0.0520054 -0.0817533 0.0407426 ] [ 1.35344 1.3045 1.28849 ] [ 0.00819716 2.75378 2.6961 ] [ 1.33497 4.09637 3.90076 ] [ 2.57675 -0.0301907 2.72622 ] [ 4.09447 1.46101 4.06258 ] [ 2.65601 2.62697 -0.116016 ] [ 4.03834 4.01266 1.20961 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.7341575019463e-18 "source-value" -17.065269 } }