{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.39006e-10 0.0 0.0 ] "source-value" [ 5.39006 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 2.3331e-11 5.36322e-10 0.0 ] "source-value" [ 0.23331 5.36322 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -1.60148e-11 -2.13292e-12 5.4933e-10 ] "source-value" [ -0.160148 -0.0213292 5.4933 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -6.73797140271723e-09 1.687769381977674e-09 6.63092597724003e-09 ] [ 1.255552117596403e-10 2.582385073052199e-10 -1.133902211349963e-09 ] [ 1.187634729117057e-09 -4.804801113826157e-10 6.47551564611074e-10 ] [ 6.821174998117966e-09 -5.784917921575645e-09 -5.312487305753591e-09 ] [ -5.772127585394137e-09 3.21819043998554e-09 6.519964992319256e-09 ] [ -8.077203603041396e-10 1.483777530917163e-09 1.151149322237551e-09 ] [ -9.270825185537396e-10 7.878623423952959e-10 -1.943895579626031e-09 ] [ 6.11053676775692e-09 -1.170440009404969e-09 -6.559306599460661e-09 ] ] "source-value" [ [ -4.205511 1.0534228 4.1386985 ] [ 0.0783654 0.1611798 -0.7077261 ] [ 0.7412633 -0.2998921 0.4041699 ] [ 4.2574426 -3.6106618 -3.3157938 ] [ -3.6026787 2.0086365 4.0694421 ] [ -0.5041394 0.9261011 0.7184909 ] [ -0.5786394 0.491745 -1.2132842 ] [ 3.8138971 -0.7305312 -4.0939972 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "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 ] ] "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 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.198509422255852e-18 "source-value" -32.446544 } }