{ "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" [ 5.18551 0 0 ] "si-unit" "m" "si-value" [ 5.18551e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.238045 5.44258 0 ] "si-unit" "m" "si-value" [ 2.38045e-11 5.44258e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0219846 -0.0831786 5.06218 ] "si-unit" "m" "si-value" [ 2.19846e-12 -8.31786e-12 5.06218e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0772431 0.350103 0.202788 ] [ 1.30878 1.27698 1.65073 ] [ 0.0902711 2.6496 2.76502 ] [ 1.60148 3.65596 4.18013 ] [ 2.76894 -0.178197 3.21948 ] [ 3.70957 1.45836 3.94737 ] [ 2.83791 2.83658 -0.151442 ] [ 4.06532 3.74454 1.70854 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.72431e-12 3.50103e-11 2.02788e-11 ] [ 1.30878e-10 1.27698e-10 1.65073e-10 ] [ 9.02711e-12 2.6496e-10 2.76502e-10 ] [ 1.60148e-10 3.65596e-10 4.18013e-10 ] [ 2.76894e-10 -1.78197e-11 3.21948e-10 ] [ 3.70957e-10 1.45836e-10 3.94737e-10 ] [ 2.83791e-10 2.83658e-10 -1.51442e-11 ] [ 4.06532e-10 3.74454e-10 1.70854e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.657374 -2.8837884 -1.0976451 ] [ 2.3013908 1.2586321 0.3522132 ] [ 1.2867512 -3.2816829 3.7439588 ] [ -6.4582793 7.080163 -4.64306 ] [ -3.3040947 -1.5761606 -3.0045819 ] [ 6.9134379 -1.5740957 -1.6585255 ] [ 2.8452363 -2.9791005 9.9520709 ] [ -1.9270682 3.9560329 -3.6444303 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.655405874721779e-09 -4.620338353814239e-09 -1.758621317155678e-09 ] [ 3.687234535084209e-09 2.016550924808408e-09 5.643077545771546e-10 ] [ 2.061602689426345e-09 -5.257835619259144e-09 5.998483258598423e-09 ] [ -1.034730410505659e-08 1.134367163005319e-08 -7.439002180971649e-09 ] [ -5.29374328124919e-09 -2.5252876639461e-09 -4.813870875458844e-09 ] [ 1.107654857273265e-08 -2.521979329441811e-09 -2.657250781100631e-09 ] [ 4.558571080511495e-09 -4.77304517211359e-09 1.594497532452402e-08 ] [ -3.087503616727138e-09 6.338263423495625e-09 -5.83902102279513e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -29.267362 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.689148314889033e-18 } }