{ "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" [ [ -3.2936394 0.037482 -0.1798033 ] [ 0.1799841 -0.9647134 1.1082708 ] [ -1.9947139 1.350907 -0.869706 ] [ 2.5581896 1.905712 -3.2431072 ] [ -1.1342954 -1.3348885 3.2200139 ] [ 1.3282074 -1.2720007 -0.615298 ] [ -1.1437892 -0.4685614 -0.8192009 ] [ 3.5000568 0.7460631 1.3988306 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.27699204402574e-09 6.005278410082561e-11 -2.880766436026887e-10 ] [ 2.883663171357293e-10 -1.545641255252479e-09 1.775645565275313e-09 ] [ -3.195883975764789e-09 2.164391612275066e-09 -1.393422620169485e-09 ] [ 4.098671568693704e-09 3.05328721237801e-09 -5.196030534588149e-09 ] [ -1.817341570960985e-09 -2.138727146074781e-09 5.15903098923103e-09 ] [ 2.128022843853554e-09 -2.037969783181234e-09 -9.858160704249985e-10 ] [ -1.832552315363535e-09 -7.507181204893172e-10 -1.312504529718319e-09 ] [ 5.607709176432061e-09 1.195324856461572e-09 2.241173683779636e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.45332 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.680248043374105e-18 } }