{ "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" [ [ -4.1194199 0.5751003999999998 -3.1004968 ] [ 2.0432382 -0.8958701 -0.5784852 ] [ -0.7169317 3.7794272 3.552843 ] [ 2.0830976 2.3571309 -3.7041188 ] [ -1.7117819 2.3870977 4.987133 ] [ -2.2442441 -2.8896119 4.5158801 ] [ 2.0507197 -1.7798504 -3.498559 ] [ 2.6153221 -3.5334237 -2.1741964 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.600038255038274e-09 9.21412415492728e-10 -4.967543485825213e-09 ] [ 3.273628474765474e-09 -1.435342129493758e-09 -9.268354629188123e-10 ] [ -1.148651208450399e-09 6.055309899855606e-09 5.692281991972935e-09 ] [ 3.33749027356459e-09 3.776540020145263e-09 -5.934652542025751e-09 ] [ -2.742576940088604e-09 3.824552126505452e-09 7.990267897420166e-09 ] [ -3.595675428388337e-09 -4.629668629365468e-09 7.235237518555967e-09 ] [ 3.28561515915399e-09 -2.851634699401528e-09 -5.605309436289427e-09 ] [ 4.19020792448156e-09 -5.661168843520633e-09 -3.483446641107525e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 140.13123 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.245149805499476e-17 } }