{ "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" [ 5.51626 0 0 ] "si-unit" "m" "si-value" [ 5.516260000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0156708 5.55287 0 ] "si-unit" "m" "si-value" [ 1.56708e-12 5.55287e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0707378 -0.0779479 5.31818 ] "si-unit" "m" "si-value" [ 7.073780000000001e-12 -7.79479e-12 5.31818e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0442334 -0.0178769 0.0866315 ] [ 1.37385 1.41168 1.32363 ] [ 0.027051 2.64271 2.7677 ] [ 1.3087 3.96384 4.18589 ] [ 2.72942 0.00808237 2.56914 ] [ 4.1019 1.31789 4.05807 ] [ 2.73169 2.7615 0.0742825 ] [ 4.00667 4.08894 1.33622 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.42334e-12 -1.78769e-12 8.66315e-12 ] [ 1.37385e-10 1.41168e-10 1.32363e-10 ] [ 2.7051e-12 2.64271e-10 2.7677e-10 ] [ 1.3087e-10 3.96384e-10 4.18589e-10 ] [ 2.72942e-10 8.082370000000001e-13 2.56914e-10 ] [ 4.1019e-10 1.31789e-10 4.05807e-10 ] [ 2.73169e-10 2.7615e-10 7.42825e-12 ] [ 4.00667e-10 4.08894e-10 1.33622e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.8666853 0.1963214 0.0869078 ] [ -0.1742823 -0.3293776 0.4673528 ] [ -1.0197324 0.7369473 -0.6023121 ] [ 1.1251506 0.7320523 -1.5754837 ] [ -0.4535065 -0.5336561 1.6656994 ] [ 0.6185826 -0.9033484 -0.2165092 ] [ -0.4412571 -0.3430182 -0.6338281 ] [ 2.2117304 0.4440794 0.808173 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.990759546051035e-09 3.145415572427251e-10 1.392416453251623e-10 ] [ -2.792310264792518e-10 -5.277210901352141e-10 7.487817298254183e-10 ] [ -1.633791410752274e-09 1.180719734821684e-09 -9.650103650449517e-10 ] [ 1.802689986199093e-09 1.172877080262868e-09 -2.524203150591481e-09 ] [ -7.265975116808352e-10 -8.550113269673068e-10 2.668744635960588e-09 ] [ 9.91078579753678e-10 -1.447323686917087e-09 -3.468859784281114e-10 ] [ -7.069718093820078e-10 -5.495757405488986e-10 -1.015504563426085e-09 ] [ 3.543582738392632e-09 7.114936324588916e-10 1.294835886161799e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.101309 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.784067326007664e-18 } }