{ "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" [ [ -5.4507956 1.5420536 1.0737132 ] [ 0.0497836 -0.1427726 0.7468147 ] [ -2.4888758 1.6038714 -1.9486203 ] [ 4.1083819 0.684807 -4.0659519 ] [ -1.7731716 -0.5640732 4.3897312 ] [ 1.2595668 -2.2646368 -0.0003733 ] [ -2.2439302 -1.7800868 -2.0222604 ] [ 6.539041 0.9208373 1.8269468 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.733137347030009e-09 2.470642246295582e-09 1.720278200657369e-09 ] [ 7.976212067640238e-11 -2.287469236954284e-10 1.19652906226772e-09 ] [ -3.987618651688057e-09 2.569685281020867e-09 -3.12203391319807e-09 ] [ 6.582353483728525e-09 1.097181774199638e-09 -6.514373129147904e-09 ] [ -2.840934105592394e-09 -9.037449009056088e-10 7.03312475818078e-09 ] [ 2.018048495922151e-09 -3.628348165456531e-09 -5.980925374722e-13 ] [ -3.595172534766946e-09 -2.852013477451831e-09 -3.240018360743493e-09 ] [ 1.047669869896799e-08 1.475344005775648e-09 2.927091474521071e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.909007 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.593039533154244e-18 } }