{ "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" [ 5.46438 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0372754 5.43203 0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.17857 -0.0223871 5.50346 ] } "unrelaxed-configuration-positions" { "source-unit" "angstrom" "source-value" [ [ 0.00726127 0.010583 0.00336114 ] [ 1.28417 1.2786 1.26313 ] [ 0.0794421 2.71348 2.73185 ] [ 1.57701 4.05847 4.12903 ] [ 2.78941 -0.159624 2.68623 ] [ 4.22148 1.3448 3.91745 ] [ 2.73822 2.68922 0.00939316 ] [ 4.14349 4.04668 1.21083 ] ] } "unrelaxed-configuration-forces" { "source-unit" "eV/angstrom" "source-value" [ [ -1.236443 -0.210666 -2.311718 ] [ 1.781847 0.895335 1.877805 ] [ 0.652604 0.872088 -0.972331 ] [ -0.820614 -0.869453 0.373919 ] [ 0.088798 1.61364 -0.837852 ] [ -0.704624 -0.985201 1.739658 ] [ -0.222676 -0.862172 -1.181391 ] [ 0.461107 -0.45357 1.311908 ] ] } "unrelaxed-potential-energy" { "source-unit" "eV" "source-value" -35.663996 } }