{ "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" [ [ -3.1563562 -0.8245261 -2.4150061 ] [ 3.4745037 -0.988204 -0.067052 ] [ -1.0042407 3.9014805 1.4561034 ] [ -0.8581388 -1.2130224 -2.1948457 ] [ -1.4438564 3.3973298 4.7245045 ] [ -3.5940208 -2.8633874 1.9965787 ] [ 4.1182252 0.2525204999999999 -2.7122209 ] [ 2.463884 -1.6621907 -0.788062 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.057040152221029e-09 -1.321036451543147e-09 -3.869266344387467e-09 ] [ 5.566768642886545e-09 -1.583277358425336e-09 -1.07429147662968e-10 ] [ -1.608970984451803e-09 6.250860895106636e-09 2.332934844167955e-09 ] [ -1.374889934088799e-09 -1.943476145798602e-09 -3.516530495775373e-09 ] [ -2.313312986931358e-09 5.443122423551892e-09 7.569490717127852e-09 ] [ -5.758256147869987e-09 -4.587652386370011e-09 3.198871741082095e-09 ] [ 6.598124188989977e-09 4.045824447059968e-10 -4.34545695222645e-09 ] [ 3.947577373686456e-09 -2.663123100792104e-09 -1.262614522543308e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -29.498071 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.726112010427301e-18 } }