{ "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" [ 5.4238 0 0 ] "si-unit" "m" "si-value" [ 5.4238e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0012341 5.50722 0 ] "si-unit" "m" "si-value" [ -1.2341e-13 5.507220000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.00966142 -0.113973 5.43239 ] "si-unit" "m" "si-value" [ -9.661420000000001e-13 -1.13973e-11 5.43239e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0339885 -0.0385369 0.0299316 ] [ 1.35039 1.32575 1.36375 ] [ -0.105411 2.62445 2.64243 ] [ 1.34087 3.97443 4.1654 ] [ 2.65221 0.0889868 2.75972 ] [ 4.05512 1.26127 4.10909 ] [ 2.71709 2.70534 0.0564386 ] [ 4.05687 4.02913 1.37335 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.39885e-12 -3.85369e-12 2.99316e-12 ] [ 1.35039e-10 1.32575e-10 1.36375e-10 ] [ -1.05411e-11 2.62445e-10 2.64243e-10 ] [ 1.34087e-10 3.97443e-10 4.1654e-10 ] [ 2.652210000000001e-10 8.89868e-12 2.75972e-10 ] [ 4.05512e-10 1.26127e-10 4.10909e-10 ] [ 2.71709e-10 2.70534e-10 5.64386e-12 ] [ 4.05687e-10 4.02913e-10 1.37335e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.0760764 0.0675866 0.2493441 ] [ -0.8938011 0.6820011 -0.9512572 ] [ 0.9757214 -0.7521353 1.398837 ] [ -0.1933146 0.1885644 -0.5609741 ] [ 0.1743386 -2.2507936 -0.0405714 ] [ 0.8304398 0.8933516 0.7082326 ] [ -0.3542529 -0.5469524 -0.4149335 ] [ -0.4630548 1.7183775 -0.3886774 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.218878294746291e-10 1.082856703993613e-10 3.994932875544173e-10 ] [ -1.432027226065323e-09 1.092686217779883e-09 -1.52408204620767e-09 ] [ 1.563278015494245e-09 -1.205053593338394e-09 2.24118393771001e-09 ] [ -3.097241325793037e-10 3.021134731951795e-10 -8.987795878943214e-10 ] [ 2.793212290230029e-10 -3.606168884166267e-09 -6.500254855312512e-11 ] [ 1.330511232541828e-09 1.431307047674273e-09 1.134713713808398e-09 ] [ -5.675757142306003e-10 -8.763143479704499e-10 -6.647967528867167e-10 ] [ -7.418955747092199e-10 2.753144256208752e-09 -6.227298433133299e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -62.30602 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -9.982524857909721e-18 } }