{ "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" [ 5.4737 0 0 ] "si-unit" "m" "si-value" [ 5.4737e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.00330015 5.48579 0 ] "si-unit" "m" "si-value" [ -3.30015e-13 5.48579e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0734366 -0.160082 5.49307 ] "si-unit" "m" "si-value" [ 7.34366e-12 -1.60082e-11 5.49307e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.150853 0.00970189 0.0764733 ] [ 1.36952 1.32009 1.51972 ] [ 0.0340703 2.70337 2.97189 ] [ 1.37909 3.89909 4.39384 ] [ 2.73154 -0.0872152 2.86586 ] [ 4.10719 1.23544 4.14892 ] [ 2.70311 2.76853 0.030971 ] [ 4.04883 4.00647 1.36661 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.50853e-11 9.70189e-13 7.647329999999999e-12 ] [ 1.36952e-10 1.32009e-10 1.51972e-10 ] [ 3.40703e-12 2.70337e-10 2.97189e-10 ] [ 1.37909e-10 3.89909e-10 4.39384e-10 ] [ 2.73154e-10 -8.72152e-12 2.86586e-10 ] [ 4.10719e-10 1.23544e-10 4.148920000000001e-10 ] [ 2.70311e-10 2.76853e-10 3.0971e-12 ] [ 4.04883e-10 4.00647e-10 1.36661e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.1968394 0.6727714 1.0219678 ] [ -0.4206039 0.3613771 -1.114359 ] [ -1.1783084 0.067394 -2.5270206 ] [ 0.7277273 2.7735314 -2.4079625 ] [ -1.1697006 -2.0501577 0.2295496 ] [ 0.2338596 0.279782 0.6835667 ] [ -0.5102628 -2.2824122 1.4465491 ] [ 1.1204494 0.177714 2.6677089 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.917548121330579e-09 1.077898617103467e-09 1.637372929860385e-09 ] [ -6.738817407492725e-10 5.789899456826813e-10 -1.785399951687606e-09 ] [ -1.887858186125925e-09 1.07977092071796e-10 -4.04873335895666e-09 ] [ 1.165947675983908e-09 4.443687202745307e-09 -3.857981253048225e-09 ] [ -1.87406697009578e-09 -3.284714762955182e-09 3.677790054640464e-10 ] [ 3.746843867565864e-10 4.482601830137879e-10 1.095194594520488e-09 ] [ -8.175311353594152e-10 -3.656827495996534e-09 2.317627167953729e-09 ] [ 1.79515784825932e-09 2.84729218334676e-10 4.274140865893842e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.205796 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.800808036657066e-18 } }