{ "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" [ 5.29616 0 0 ] "si-unit" "m" "si-value" [ 5.29616e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.242438 5.47618 0 ] "si-unit" "m" "si-value" [ -2.42438e-11 5.47618e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.11809 -0.0034447 5.45685 ] "si-unit" "m" "si-value" [ 1.1809e-11 -3.4447e-13 5.456850000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0183909 -0.0832388 -0.0590634 ] [ 1.37993 1.35458 1.33752 ] [ -0.123201 2.75975 2.68859 ] [ 1.45379 4.06883 4.12913 ] [ 2.80695 0.0674874 2.75473 ] [ 4.11558 1.36445 4.01895 ] [ 2.83757 2.84317 -0.0421665 ] [ 3.94058 4.22423 1.31424 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.83909e-12 -8.32388e-12 -5.90634e-12 ] [ 1.37993e-10 1.35458e-10 1.33752e-10 ] [ -1.23201e-11 2.75975e-10 2.68859e-10 ] [ 1.45379e-10 4.06883e-10 4.12913e-10 ] [ 2.80695e-10 6.748740000000001e-12 2.75473e-10 ] [ 4.11558e-10 1.36445e-10 4.01895e-10 ] [ 2.83757e-10 2.84317e-10 -4.21665e-12 ] [ 3.94058e-10 4.224230000000001e-10 1.31424e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 3.0364077 2.9292687 -1.778747 ] [ -0.0155158 0.6469223 -0.1735914 ] [ 2.78577 1.0801707 -0.9366826 ] [ -1.5895246 -0.0987773 -0.4387272 ] [ -0.4580218 -0.6464806 -1.5178363 ] [ -0.03790450000000001 -0.465775 2.0019157 ] [ -2.650774 -2.3265855 -0.161953 ] [ -1.0704369 -1.1187433 3.0056218 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.8648614281571e-09 4.693205827181209e-09 -2.849866857718138e-09 ] [ -2.485905201300864e-11 1.036483784534164e-09 -2.781240826519411e-10 ] [ 4.463295564926016e-09 1.730624242013171e-09 -1.500730962830158e-09 ] [ -2.546699152306472e-09 -1.582586807257478e-10 -7.029184627490458e-10 ] [ -7.338318197767334e-10 -1.035776103120756e-09 -2.431841834061575e-09 ] [ -6.072970372311362e-11 -7.4625381555312e-10 3.207422531352467e-09 ] [ -4.247008129824499e-09 -3.727600894392278e-09 -2.594773102684224e-10 ] [ -1.715028975221628e-09 -1.792424359936641e-09 4.815536978926813e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.782768 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.733031431711037e-18 } }