{ "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" [ 5.31945 0 0 ] "si-unit" "m" "si-value" [ 5.31945e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.00383334 5.41695 0 ] "si-unit" "m" "si-value" [ -3.83334e-13 5.416950000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0189848 -0.118491 5.47074 ] "si-unit" "m" "si-value" [ 1.89848e-12 -1.18491e-11 5.47074e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0147515 -0.0960157 0.0381768 ] [ 1.54242 1.27348 1.38773 ] [ -0.0738039 2.51333 2.6891 ] [ 1.45374 4.04036 4.07661 ] [ 2.81495 -0.0309523 2.80877 ] [ 4.27456 1.30079 3.98727 ] [ 2.73206 2.74248 -0.103972 ] [ 3.9224 4.04214 1.39211 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.47515e-12 -9.60157e-12 3.81768e-12 ] [ 1.54242e-10 1.27348e-10 1.38773e-10 ] [ -7.38039e-12 2.51333e-10 2.6891e-10 ] [ 1.45374e-10 4.04036e-10 4.07661e-10 ] [ 2.81495e-10 -3.09523e-12 2.80877e-10 ] [ 4.27456e-10 1.30079e-10 3.98727e-10 ] [ 2.73206e-10 2.74248e-10 -1.03972e-11 ] [ 3.9224e-10 4.04214e-10 1.39211e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.6666525 1.2889761 -0.2521743 ] [ -1.3605529 0.2605851 -0.8625257 ] [ 4.0265908 3.6845987 -2.6638442 ] [ -1.1984853 -1.2366713 0.1504298 ] [ -0.8590697 0.2486034 -0.5180375 ] [ -3.5653048 -2.5534117 4.1961282 ] [ -0.0916526 -0.7312423 0.4559562 ] [ 1.381822 -0.9614379 -0.5059324 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.670271670497872e-09 2.065167372189963e-09 -4.040277678266055e-10 ] [ -2.179846047741641e-09 4.175033549488302e-10 -1.381918511379155e-09 ] [ 6.451309641288369e-09 5.903377894170074e-09 -4.26794889869368e-09 ] [ -1.920185128032474e-09 -1.981365844474343e-09 2.410151086316199e-10 ] [ -1.37638138897767e-09 3.983065553313907e-10 -8.299875711976802e-10 ] [ -5.71224799658602e-09 -4.091016529017183e-09 6.722938499919587e-09 ] [ -1.468436529555341e-10 -1.17157931720002e-09 7.305223637488089e-10 ] [ 2.213922902507098e-09 -1.540393325731048e-09 -8.105930629852339e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -35.150296 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.631698246539976e-18 } }