{ "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" [ [ -2.6428131 0.2442636 0.0530242 ] [ -0.047286 -0.4801878 0.6469356 ] [ -1.5582692 1.0963168 -0.8910548 ] [ 2.0311987 1.4481417 -2.5437498 ] [ -1.0404095 -1.0923882 2.6560771 ] [ 0.9152396 -1.2314995 -0.2694061 ] [ -0.7042769 -0.4293759 -0.7351557 ] [ 3.0466165 0.4447294 1.0833295 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.234253361963973e-09 3.913534292324429e-10 8.495413357662336e-11 ] [ -7.57605236911488e-11 -7.693456667533863e-10 1.036505093483221e-09 ] [ -2.496622481152719e-09 1.756493145950269e-09 -1.42762716841162e-09 ] [ 3.254339069339353e-09 2.320178775345568e-09 -4.075536458724676e-09 ] [ -1.666919776958218e-09 -1.750198834877795e-09 4.255504632662264e-09 ] [ 1.466375489550344e-09 -1.97307970742689e-09 -4.316361549209069e-10 ] [ -1.1283759837495e-09 -6.879360285149587e-10 -1.177849275187859e-09 ] [ 4.881217728843522e-09 7.125350472624115e-10 1.735685197522954e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -33.447923 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.358948024491861e-18 } }