{ "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" [ [ -5.0672617 4.7904023 4.5335748 ] [ -3.9754104 -3.6181633 3.3748838 ] [ 0.6470614 0.6566034 -2.0335859 ] [ 4.8911022 -4.5229778 -3.2372178 ] [ -4.8489925 -2.7934546 -2.8388478 ] [ 4.0612052 3.5241725 4.789065 ] [ 2.0275743 2.8216766 -4.0634396 ] [ 2.2647214 -0.8582591 -0.5244324 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.118648227215265e-09 7.67507056928655e-09 7.263587553208037e-09 ] [ -6.369309600965177e-09 -5.796936649496576e-09 5.407159922276663e-09 ] [ 1.036706647302117e-09 1.051994616617791e-09 -3.258163785368526e-09 ] [ 7.836409594783445e-09 -7.246609287557418e-09 -5.18659467559761e-09 ] [ -7.768942417934544e-09 -4.475607651386215e-09 -4.548335575169514e-09 ] [ 6.506768023711388e-09 5.646346787166288e-09 7.672927978491551e-09 ] [ 3.248532140394926e-09 4.520824279978433e-09 -6.510347927152904e-09 ] [ 3.628483679705445e-09 -1.375082664608849e-09 -8.40233330470034e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -30.942392 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.957517705402896e-18 } }