{ "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" [ [ -2.1086654 -0.0143434 -0.1856607 ] [ -0.3313579 -0.6201971 0.6972614 ] [ -1.0893298 1.0005583 -0.5200929 ] [ 1.2208127 1.0950047 -1.8130206 ] [ -0.2784284 -0.7574044 1.9062768 ] [ 0.7854698 -0.9699021 -0.4504018 ] [ -0.51863 -0.4243682 -0.7487019 ] [ 2.320129 0.6906523 1.1143396 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.37845440496988e-09 -2.298066014278272e-11 -2.974612329413626e-10 ] [ -5.308938804973844e-10 -9.936652939079596e-10 1.117135913666277e-09 ] [ -1.74529873790074e-09 1.603071116007392e-09 -8.332806850240723e-10 ] [ 1.955957566315724e-09 1.754390930006118e-09 -2.904779218348788e-09 ] [ -4.460914730467508e-10 -1.213495622171052e-09 3.054192121733438e-09 ] [ 1.258461349904452e-09 -1.553954469084824e-09 -7.216232339262375e-10 ] [ -8.30936860845504e-10 -6.799128086509785e-10 -1.19955268012854e-09 ] [ 3.717256441040084e-09 1.106546968161748e-09 1.785368854751624e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.810355 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.737451356354839e-18 } }