{ "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" [ 5.51526 0 0 ] "si-unit" "m" "si-value" [ 5.51526e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0933018 5.35906 0 ] "si-unit" "m" "si-value" [ -9.33018e-12 5.35906e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.235006 -0.443739 5.60819 ] "si-unit" "m" "si-value" [ 2.35006e-11 -4.43739e-11 5.60819e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0139599 -0.0171452 -0.258284 ] [ 1.4668 1.50235 1.27166 ] [ -0.150248 2.65293 3.01531 ] [ 1.35939 3.8116 4.44507 ] [ 2.6266 -0.11212 2.88055 ] [ 3.83653 1.13315 3.7283 ] [ 2.72617 2.6833 0.230289 ] [ 3.93014 4.1583 1.51189 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.39599e-12 -1.71452e-12 -2.58284e-11 ] [ 1.4668e-10 1.50235e-10 1.27166e-10 ] [ -1.50248e-11 2.65293e-10 3.01531e-10 ] [ 1.35939e-10 3.8116e-10 4.44507e-10 ] [ 2.6266e-10 -1.1212e-11 2.88055e-10 ] [ 3.83653e-10 1.13315e-10 3.7283e-10 ] [ 2.72617e-10 2.6833e-10 2.30289e-11 ] [ 3.930140000000001e-10 4.1583e-10 1.51189e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.5496424 6.8952574 6.0075802 ] [ -4.5530459 -3.8213465 3.4702887 ] [ 0.4510254 0.2981166 -2.3454362 ] [ 7.0302733 -6.3003976 -4.469587 ] [ -5.5113539 -3.3081756 -3.1776479 ] [ 5.0712682 4.0796657 5.5693493 ] [ 2.4094933 2.8810687 -4.2604982 ] [ 2.6519821 -0.7241887 -0.7940489 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.20958605486804e-08 1.104742020067819e-08 9.625204544020986e-09 ] [ -7.294783694409295e-09 -6.122472022275908e-09 5.560015422566425e-09 ] [ 7.226223512669683e-10 4.776354467923853e-10 -3.757803045217993e-09 ] [ 1.126373951909446e-08 -1.009434973646443e-08 -7.16106779603161e-09 ] [ -8.8301623675349e-09 -5.300281603821013e-09 -5.091153174514217e-09 ] [ 8.125067347846497e-09 6.536345005219666e-09 8.923081241528845e-09 ] [ 3.860433833234241e-09 4.615980914058649e-09 -6.826070609000482e-09 ] [ 4.248943719400088e-09 -1.160278204187545e-09 -1.272206583351957e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.764318038775915 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.884851532138248e-18 } }