{ "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" [ [ 1.1722941 1.8658562 -0.7805693 ] [ -2.2001827 0.9422285 -0.8439497 ] [ 9.8832736 11.2265728 -10.6446347 ] [ -1.7505766 -1.2742577 -0.4812359 ] [ -0.6758068 0.7304739 0.4905966 ] [ -9.1222906 -9.8376481 12.2179388 ] [ 0.370983 -1.829982 0.1794698 ] [ 2.322306 -1.8232437 -0.1376156 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.878222199721777e-09 2.989431181414729e-09 -1.250609883374221e-09 ] [ -3.525081283428621e-09 1.509616474151453e-09 -1.352156478471174e-09 ] [ 1.583474989888985e-08 1.79869524718692e-08 -1.705458485329642e-08 ] [ -2.804732901439553e-09 -2.04158589581438e-09 -7.710249080696468e-10 ] [ -1.082761855137662e-09 1.170348204684597e-09 7.860224027639693e-10 ] [ -1.46155207274636e-08 -1.576164978947754e-08 1.957529589972521e-08 ] [ 5.943802893142464e-10 -2.931954376884826e-09 2.875423176996519e-10 ] [ 3.720744379543565e-09 -2.921158430160889e-09 -2.204844969773645e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -34.250384 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.487516449822239e-18 } }