{ "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" [ [ -7.2575757 -0.8944429 6.9997938 ] [ -0.2760891 0.0430862 -0.4369814 ] [ 1.0802471 -0.320355 0.0661123 ] [ 7.1656847 -2.0987433 -6.2375643 ] [ -6.4180314 0.4972643 6.746292 ] [ -0.8427349 0.8638778 0.8574803 ] [ -0.1939103 0.5009223 -1.2364975 ] [ 6.7424097 1.4083905 -6.7586353 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.162791820602619e-08 -1.433055514827199e-09 1.121490606917807e-08 ] [ -4.423435049220893e-10 6.903170288785079e-11 -7.001213885726076e-10 ] [ 1.730746662566261e-09 -5.1326529558507e-10 1.059235822799982e-10 ] [ 1.14806925929513e-08 -3.362557476024052e-09 -9.993679774532564e-09 ] [ -1.028281994535831e-08 7.967052423823661e-10 1.080875140854113e-08 ] [ -1.350210165436326e-09 1.384084825791325e-09 1.37383490077531e-09 ] [ -3.106785517519301e-10 8.025660045095382e-10 -1.981087402499415e-09 ] [ 1.080253127819495e-08 2.256490350647577e-09 -1.082852755538758e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -33.724141 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.40320307119214e-18 } }