{ "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" [ [ -3.7252333 -0.9353731 -1.7133124 ] [ 3.8135351 -1.7868242 -0.649701 ] [ -1.4048319 4.819317 1.5743489 ] [ 0.1687296 0.3321106999999999 -3.0051241 ] [ -3.1969314 3.3921605 5.0608445 ] [ -2.5644783 -2.4926303 2.5173337 ] [ 3.0077522 -0.14345560000000004 -2.1156275 ] [ 3.901458 -3.185305 -1.6687622 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.968481700285633e-09 -1.49863291254522e-09 -2.745029071406738e-09 ] [ 6.109956779820191e-09 -2.862807958719664e-09 -1.040935752710381e-09 ] [ -2.250788826334044e-09 7.721397025623993e-09 2.522385000562197e-09 ] [ 2.703346203569357e-10 5.320999990575225e-10 -4.814739575622641e-09 ] [ -5.122048747381413e-09 5.434840247101239e-09 8.108366739404266e-09 ] [ -4.108747176808929e-09 -3.99363399095769e-09 4.033213200891961e-09 ] [ 4.818950255999766e-09 -2.298412084428365e-10 -3.389608918821552e-09 ] [ 6.250824794633126e-09 -5.103421201117345e-09 -2.673651782514774e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -29.743669 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.765461108861372e-18 } }