{ "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" [ 5.39006 0 0 ] "si-unit" "m" "si-value" [ 5.39006e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.23331 5.36322 0 ] "si-unit" "m" "si-value" [ 2.3331e-11 5.36322e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.160148 -0.0213292 5.4933 ] "si-unit" "m" "si-value" [ -1.60148e-11 -2.13292e-12 5.4933e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.105355 0.0424721 -0.0304949 ] [ 1.33629 1.36991 1.45967 ] [ -0.05353 2.71357 2.83859 ] [ 1.26119 4.17265 4.20892 ] [ 2.69817 -0.0783338 2.63037 ] [ 3.99124 1.24872 4.05842 ] [ 2.76699 2.61469 0.0747626 ] [ 4.02836 3.96527 1.47431 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.05355e-11 4.24721e-12 -3.04949e-12 ] [ 1.33629e-10 1.36991e-10 1.45967e-10 ] [ -5.353e-12 2.71357e-10 2.83859e-10 ] [ 1.26119e-10 4.17265e-10 4.20892e-10 ] [ 2.69817e-10 -7.83338e-12 2.63037e-10 ] [ 3.99124e-10 1.24872e-10 4.05842e-10 ] [ 2.76699e-10 2.61469e-10 7.47626e-12 ] [ 4.02836e-10 3.96527e-10 1.47431e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.8168415 -0.4224058 3.1425966 ] [ 0.2018106 0.0248135 -0.8588049 ] [ 0.6341952 -0.2854629 0.2334317 ] [ 4.0407861 -2.5850695 -2.296509 ] [ -3.2786868 0.8214664 3.5923607 ] [ -0.5855596 1.1806145 0.9814405 ] [ -0.7140529 0.7041128 -1.3843441 ] [ 3.5183488 0.5619311 -3.4101714 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.115254266981511e-09 -6.767687028260771e-10 5.034994842607844e-09 ] [ 3.233362278135204e-10 3.975560990775899e-11 -1.375957143944706e-09 ] [ 1.016092730834957e-09 -4.573619882538786e-10 3.739988153748978e-10 ] [ 6.474053072411987e-09 -4.141737950166062e-09 -3.679413059570705e-09 ] [ -5.25303538116423e-09 1.316134271696098e-09 5.755596374439883e-09 ] [ -9.381699089343863e-10 1.891552965661593e-09 1.572441036761277e-09 ] [ -1.144038871819938e-09 1.128113075860315e-09 -2.217963770435759e-09 ] [ 5.637016237621938e-09 9.003128783379173e-10 -5.463696935015067e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.971534 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.603057462993655e-18 } }