{ "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" [ 5.46856 0 0 ] "si-unit" "m" "si-value" [ 5.46856e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.109414 5.47364 0 ] "si-unit" "m" "si-value" [ 1.09414e-11 5.47364e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0853482 0.188746 5.50226 ] "si-unit" "m" "si-value" [ 8.53482e-12 1.88746e-11 5.50226e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.111998 0.00598912 -0.142628 ] [ 1.42992 1.39997 1.14788 ] [ 0.0344059 2.83471 2.60329 ] [ 1.5648 4.17845 4.01026 ] [ 2.81953 0.00757671 2.62729 ] [ 4.17997 1.38562 3.91338 ] [ 2.81257 2.67111 -0.166315 ] [ 4.15871 3.96748 1.06238 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.11998e-11 5.98912e-13 -1.42628e-11 ] [ 1.42992e-10 1.39997e-10 1.14788e-10 ] [ 3.44059e-12 2.83471e-10 2.60329e-10 ] [ 1.5648e-10 4.17845e-10 4.01026e-10 ] [ 2.81953e-10 7.576710000000001e-13 2.62729e-10 ] [ 4.17997e-10 1.38562e-10 3.91338e-10 ] [ 2.81257e-10 2.67111e-10 -1.66315e-11 ] [ 4.15871e-10 3.96748e-10 1.06238e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.5695991 -0.0906666 1.1006463 ] [ -0.9054481 -0.468123 2.7900195 ] [ 1.906554 0.8989289 0.9415067 ] [ -2.2637638 -0.5431056 -2.0440288 ] [ 0.3886203 -0.1123209 -1.872853 ] [ 0.1172705 -0.7673954 -0.4095804 ] [ 0.6938065 -1.3463831 -0.8319523 ] [ 0.6325596 2.4290657 0.326242 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.125983687674293e-10 -1.452639080042244e-10 1.763429784158554e-09 ] [ -1.450687789119695e-09 -7.50015732437982e-10 4.470104051304363e-09 ] [ 3.054636270259236e-09 1.440242879207323e-09 1.508460035494448e-09 ] [ -3.626949465255048e-09 -8.701511021145502e-10 -3.274895182583059e-09 ] [ 6.2263836415807e-10 -1.799579214898506e-10 -3.000641315516802e-09 ] [ 1.87888054957497e-10 -1.229502978919083e-09 -6.562201466243735e-10 ] [ 1.111600562817321e-09 -2.157143543232485e-09 -1.332934535662558e-09 ] [ 1.013472210732386e-09 3.891792306990853e-09 5.226973094294278e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -325.71433 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.218518888849652e-17 } }