{ "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" [ [ 2.0958869 1.3988935 19.5403342 ] [ -5.9408005 8.9318856 -16.0510153 ] [ -2.1302917 -0.0630856 7.2582283 ] [ -17.8676564 11.8758393 -34.49144 ] [ 2.8372218 -10.0944347 11.8997787 ] [ -3.9009051 4.2336009 -12.413012 ] [ 16.7604543 -25.601327 22.5266787 ] [ 8.1460905 9.318628 1.7304475 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.357981018686694e-09 2.241274479154479e-09 3.130706687579108e-08 ] [ -9.518211748355517e-09 1.431045840588107e-08 -2.57165616656365e-08 ] [ -3.413103585344138e-09 -1.010742742618704e-10 1.162896378649754e-08 ] [ -2.862714158842056e-08 1.902719223559892e-08 -5.526137924101295e-08 ] [ 4.54573047343542e-09 -1.61730674097788e-08 1.906554738291089e-08 ] [ -6.249939002671433e-09 6.782976439661369e-09 -1.988783778396161e-08 ] [ 2.685320825468482e-08 -4.101784791879331e-08 3.609171825476549e-08 ] [ 1.305147585754938e-08 1.493008804253815e-08 2.772482550863714e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.81278 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.533486663458252e-18 } }