{ "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" [ 5.34161 0 0 ] "si-unit" "m" "si-value" [ 5.341610000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0977669 5.5284 0 ] "si-unit" "m" "si-value" [ -9.776690000000001e-12 5.5284e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.072801 -0.0524088 5.47046 ] "si-unit" "m" "si-value" [ -7.280100000000001e-12 -5.24088e-12 5.470460000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0796719 -0.127908 0.00668105 ] [ 1.22031 1.46092 1.38882 ] [ -0.251468 2.67688 2.66146 ] [ 1.14494 4.10147 3.98362 ] [ 2.6636 -0.086404 2.79747 ] [ 4.00012 1.38046 4.02333 ] [ 2.71061 2.85329 -0.00699576 ] [ 4.09739 4.08725 1.448 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -7.967190000000001e-12 -1.27908e-11 6.68105e-13 ] [ 1.22031e-10 1.46092e-10 1.38882e-10 ] [ -2.51468e-11 2.67688e-10 2.66146e-10 ] [ 1.14494e-10 4.10147e-10 3.98362e-10 ] [ 2.663600000000001e-10 -8.6404e-12 2.79747e-10 ] [ 4.00012e-10 1.38046e-10 4.02333e-10 ] [ 2.71061e-10 2.85329e-10 -6.99576e-13 ] [ 4.09739e-10 4.08725e-10 1.448e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.443445 3.0033348 -1.1691164 ] [ 1.5834698 -2.352218 -1.0348068 ] [ 5.8849691 0.3390232 1.0967833 ] [ 0.3117792 -1.1476673 2.5290662 ] [ -0.2040235 1.5813911 -2.5472776 ] [ -3.3000232 -1.7669797 3.1225487 ] [ -1.378975 -1.2080203 -0.484927 ] [ -6.3406414 1.5511362 -1.5122704 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.517007074010656e-09 4.811872800995044e-09 -1.873130963073861e-09 ] [ 2.536998293302852e-09 -3.768668686624935e-09 -1.657943262004861e-09 ] [ 9.428759906150418e-09 5.431750449488026e-10 1.757240561343873e-09 ] [ 4.995253450917273e-10 -1.83876571651666e-09 4.052010738095497e-09 ] [ -3.268816817937888e-10 2.533667848761195e-09 -4.081188617407535e-09 ] [ -5.287220019137602e-09 -2.831013564768198e-09 5.002874524449433e-09 ] [ -2.20936150566768e-09 -1.935461882111802e-09 -7.769387021946816e-10 ] [ -1.015882741195658e-08 2.485194155316553e-09 -2.422924279207865e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.617775 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.546378976911473e-18 } }