{ "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" [ 5.44445 0 0 ] "si-unit" "m" "si-value" [ 5.44445e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.167308 5.39053 0 ] "si-unit" "m" "si-value" [ 1.67308e-11 5.39053e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.00577721 0.0671422 5.23553 ] "si-unit" "m" "si-value" [ 5.77721e-13 6.71422e-12 5.23553e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0663122 0.114884 -0.548352 ] [ 1.65266 1.49476 1.67932 ] [ 0.0154179 2.74054 2.60324 ] [ 1.52833 4.11061 4.06642 ] [ 2.73369 0.0515698 2.61947 ] [ 3.80738 1.47511 4.06717 ] [ 2.81179 3.14543 -0.204063 ] [ 4.02065 4.01269 1.26672 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -6.63122e-12 1.14884e-11 -5.48352e-11 ] [ 1.65266e-10 1.49476e-10 1.67932e-10 ] [ 1.54179e-12 2.74054e-10 2.60324e-10 ] [ 1.52833e-10 4.11061e-10 4.06642e-10 ] [ 2.733690000000001e-10 5.15698e-12 2.61947e-10 ] [ 3.807380000000001e-10 1.47511e-10 4.06717e-10 ] [ 2.81179e-10 3.14543e-10 -2.04063e-11 ] [ 4.02065e-10 4.01269e-10 1.26672e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.9424068 1.1956043 3.2266605 ] [ -2.1525524 0.8487859 -3.8745032 ] [ -0.4106912 -0.065586 -0.7187658 ] [ -3.8334695 0.4801501 -1.6977872 ] [ 0.909408 -1.3061737 -0.7752104 ] [ 0.1809971 0.4089589 0.9476117 ] [ 0.9457691 -2.6120863 2.5423322 ] [ 3.418132 1.0503468 0.3496622 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.509902142242941e-09 1.915569257187949e-09 5.169680016358839e-09 ] [ -3.44876913032693e-09 1.359904925044687e-09 -6.207638444254787e-09 ] [ -6.579998390082969e-10 -1.050803558517888e-10 -1.151589760590609e-09 ] [ -6.141895209449865e-09 7.692852646947821e-10 -2.720154958933494e-09 ] [ 1.457032236368486e-09 -2.092720964843833e-09 -1.242023979081016e-09 ] [ 2.899893220525997e-10 6.552243884480851e-10 1.518241311336543e-09 ] [ 1.515289140695057e-09 -4.185023601371975e-09 4.07326521314703e-09 ] [ 5.476451177208346e-09 1.682841086692093e-09 5.602206020174937e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 687.74863 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.10189477597323e-16 } }