{ "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" [ 5.46441 0 0 ] "si-unit" "m" "si-value" [ 5.46441e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.239301 5.60761 0 ] "si-unit" "m" "si-value" [ 2.39301e-11 5.60761e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.167861 -0.733416 5.71653 ] "si-unit" "m" "si-value" [ 1.67861e-11 -7.33416e-11 5.71653e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.00327702 -0.0382766 0.433443 ] [ 1.09616 1.45225 1.46895 ] [ 0.130178 2.57242 2.88603 ] [ 1.56489 3.87283 4.50025 ] [ 2.74098 -0.214768 2.33093 ] [ 4.21449 1.24218 3.87733 ] [ 2.20243 2.94328 0.228142 ] [ 4.00805 4.02926 1.38377 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.27702e-13 -3.82766e-12 4.33443e-11 ] [ 1.09616e-10 1.45225e-10 1.46895e-10 ] [ 1.30178e-11 2.57242e-10 2.88603e-10 ] [ 1.56489e-10 3.87283e-10 4.500250000000001e-10 ] [ 2.74098e-10 -2.14768e-11 2.33093e-10 ] [ 4.21449e-10 1.24218e-10 3.87733e-10 ] [ 2.20243e-10 2.94328e-10 2.28142e-11 ] [ 4.00805e-10 4.02926e-10 1.38377e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -12.2707366 -5.3421397 -3.0604789 ] [ 15.6651612 -5.4242195 -3.4934103 ] [ -4.0599265 18.1684623 6.5813937 ] [ 1.4518158 -1.7290456000000003 -7.9579471 ] [ -20.8929005 28.9596013 22.9732654 ] [ -8.427135 -8.079565 5.7983163 ] [ 6.2785615 0.21958729999999996 -3.0010773 ] [ 22.25516 -26.772681 -17.840062 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.965988730051488e-08 -8.559051332387525e-09 -4.903427742031701e-09 ] [ 2.509835503570327e-08 -8.690557668987466e-09 -5.597060309521914e-09 ] [ -6.504719320466372e-09 2.91090855329462e-08 1.054455511842041e-08 ] [ 2.326065332468049e-09 -2.770236436617109e-09 -1.275003679318316e-08 ] [ -3.347411672180063e-08 4.639839615054929e-08 3.680722872731356e-08 ] [ -1.350175867732541e-08 -1.294489014923395e-08 9.289926815863558e-09 ] [ 1.005936444755498e-08 3.518176382845958e-10 -4.808255887273588e-09 ] [ 3.565669704416332e-08 -4.289456357433637e-08 -2.858293025002249e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -19.426429 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.112457036943112e-18 } }