{ "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" [ 5.48715 0 0 ] "si-unit" "m" "si-value" [ 5.48715e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0853536 5.45185 0 ] "si-unit" "m" "si-value" [ 8.53536e-12 5.45185e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0925937 0.0373061 5.50955 ] "si-unit" "m" "si-value" [ -9.25937e-12 3.73061e-12 5.50955e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.108625 -0.0346204 -0.093953 ] [ 1.31877 1.39109 1.34024 ] [ -0.0198257 2.75858 2.57664 ] [ 1.43337 4.133 3.94558 ] [ 2.6449 -0.0446732 2.70542 ] [ 4.12571 1.36749 4.0773 ] [ 2.7517 2.72879 0.0316261 ] [ 4.07324 4.11206 1.36119 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.08625e-11 -3.46204e-12 -9.3953e-12 ] [ 1.31877e-10 1.39109e-10 1.34024e-10 ] [ -1.98257e-12 2.75858e-10 2.57664e-10 ] [ 1.43337e-10 4.133e-10 3.94558e-10 ] [ 2.6449e-10 -4.467320000000001e-12 2.70542e-10 ] [ 4.12571e-10 1.36749e-10 4.0773e-10 ] [ 2.7517e-10 2.72879e-10 3.16261e-12 ] [ 4.07324e-10 4.11206e-10 1.36119e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.0157669 -0.289583 0.4017171 ] [ 0.8164713 -0.6764102 -0.5579547 ] [ -0.0918927 -0.0870982 1.9118265 ] [ -1.4700688 -1.5635364 1.7100579 ] [ 1.3068833 2.1002023 -0.5047889 ] [ -0.7813807 0.4216869 -0.2775569 ] [ 0.2964654 -0.3379386 -1.372438 ] [ 0.9392891 0.4326773 -1.3108631 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.627437992770614e-09 -4.639631162036219e-10 6.436217510982413e-10 ] [ 1.308131239191604e-09 -1.083728617439267e-09 -8.939419831704797e-10 ] [ -1.472283367751718e-10 -1.395467009034588e-10 3.063083746562001e-09 ] [ -2.355309881732419e-09 -2.505061486488478e-09 2.739814810167108e-09 ] [ 2.093857886624812e-09 3.364895051733058e-09 -8.087609806825625e-10 ] [ -1.251909899798564e-09 6.756168980438944e-10 -4.446951797854745e-10 ] [ 4.749899366694635e-10 -5.414373286466723e-10 -2.198888095213692e-09 ] [ 1.504907048590889e-09 6.932254601222081e-10 -2.100234229192805e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.358754 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.825314610015403e-18 } }