{ "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" [ [ 2.2333761 2.73081 -1.3732545 ] [ 1.3535458 -1.9037976 -0.9375857 ] [ 4.6255343 -0.2208597 1.3167051 ] [ 0.0022268 -1.0807012 1.8589824 ] [ -0.0052297 1.2916087 -1.9661593 ] [ -2.2952226 -1.9858794 3.1000374 ] [ -1.0446372 -0.8029385 -0.4515255 ] [ -4.8695933 1.9717576 -1.5471999 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.578263002354047e-09 4.375239973893539e-09 -2.200196272435353e-09 ] [ 2.168619453808837e-09 -3.050220030585278e-09 -1.502177900912534e-09 ] [ 7.410922975225546e-09 -3.538562507322497e-10 2.109594145088633e-09 ] [ 3.5677269285912e-12 -1.731474210975761e-09 2.978418164297242e-09 ] [ -8.3789031428298e-12 2.069385279411116e-09 -3.150134489181796e-09 ] [ -3.677352019548727e-09 -3.181729572621939e-09 4.966807486806112e-09 ] [ -1.673693312847185e-09 -1.286449303239009e-09 -7.23423605755167e-10 ] [ -7.80194860234295e-09 3.159103954631918e-09 -2.478887527907137e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.108438 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.624991901983769e-18 } }