{ "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" [ [ -1.3396089 -1.1955329 -0.7324515 ] [ -0.0522972 -0.1593992 2.0167017 ] [ 1.1232142 -0.827507 -0.2297817 ] [ -0.9938136 0.3021213 -0.7258978 ] [ -0.3724978 -0.3185824 -1.5946791 ] [ 0.5152667 0.8512359 0.9652882 ] [ -0.1570427 -1.3558377 -1.4230838 ] [ 1.2767793 2.7035019 1.7239041 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.146290060595605e-09 -1.915454861777224e-09 -1.173516669169891e-09 ] [ -8.378935117330177e-11 -2.553856716142233e-10 3.231112314867615e-09 ] [ 1.799587531390576e-09 -1.325812368948346e-09 -3.681508676276794e-10 ] [ -1.592264915353083e-09 4.84051683505703e-10 -1.163016484250154e-09 ] [ -5.968072664594342e-10 -5.10425273078354e-10 -2.554957571698385e-09 ] [ 8.255482602167673e-10 1.363830257765647e-09 1.546562186374114e-09 ] [ -2.516101424073082e-10 -2.172291464539244e-09 -2.280031593799223e-09 ] [ 2.04562594438139e-09 4.33148753846838e-09 2.761998845521266e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.256722 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.808967233524503e-18 } }