{ "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" [ 5.50751 0 0 ] "si-unit" "m" "si-value" [ 5.50751e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0552432 5.46365 0 ] "si-unit" "m" "si-value" [ 5.52432e-12 5.46365e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.041151 -0.173599 5.4807 ] "si-unit" "m" "si-value" [ -4.115100000000001e-12 -1.73599e-11 5.4807e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0203681 -0.0104771 -0.043973 ] [ 1.36957 1.30557 1.36025 ] [ 0.0138031 2.57027 2.84477 ] [ 1.29725 4.08516 4.13225 ] [ 2.77149 -0.00701058 2.61036 ] [ 3.98017 1.30013 4.07827 ] [ 2.6961 2.74296 0.249943 ] [ 4.17055 4.00651 1.44609 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.03681e-12 -1.04771e-12 -4.3973e-12 ] [ 1.36957e-10 1.30557e-10 1.36025e-10 ] [ 1.38031e-12 2.57027e-10 2.84477e-10 ] [ 1.29725e-10 4.08516e-10 4.13225e-10 ] [ 2.77149e-10 -7.01058e-13 2.61036e-10 ] [ 3.98017e-10 1.30013e-10 4.07827e-10 ] [ 2.6961e-10 2.74296e-10 2.49943e-11 ] [ 4.170550000000001e-10 4.00651e-10 1.44609e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.8557759 0.2182602 0.2280039 ] [ -0.4889471 -0.0493686 -0.0582594 ] [ 0.081671 -0.0045882 0.1648032 ] [ 0.9116555 -0.2899547 -0.3967328 ] [ -0.1754468 -0.4402109 0.4347966 ] [ -0.0905074 0.1312695 0.5481657 ] [ -0.0496375 0.3252694 -0.7416969 ] [ 0.6669883 0.1093233 -0.1790804 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.371104139624079e-09 3.496913896911322e-10 3.653025180312211e-10 ] [ -7.833796124279597e-10 -7.909721672162689e-11 -9.334184862183554e-11 ] [ 1.308513667973568e-10 -7.35110677155456e-12 2.640438340730266e-10 ] [ 1.460633128323734e-09 -4.645586414310778e-10 -6.356360168645223e-10 ] [ -2.810967611541735e-10 -7.052956122013267e-10 6.966209473233293e-10 ] [ -1.450088402893939e-10 2.103169239241056e-10 8.782582688644665e-10 ] [ -7.952804201496e-11 5.211390281416435e-10 -1.188329432899836e-09 ] [ 1.068633060607137e-09 1.751552353687046e-10 -2.869184301235123e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 146.18631 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.342162881630213e-17 } }