{ "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" [ [ 3.3231492 2.8177052 -1.7492826 ] [ -0.126118 0.8221693 -0.2042719 ] [ 3.5900576 1.0041138 -1.055538 ] [ -1.9933357 -0.0299461 -0.6126037 ] [ -0.5838088 -0.6982958 -1.6891332 ] [ -0.1812484 -0.4143813 2.1640285 ] [ -2.6173886 -2.0764397 0.0055023 ] [ -1.4113073 -1.4249256 3.1412985 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.324271955670223e-09 4.514461395746588e-09 -2.802659684892238e-09 ] [ -2.020633110620544e-10 1.317260430799501e-09 -3.272796624663956e-10 ] [ 5.751906354045358e-09 1.608767654982647e-09 -1.691158305965991e-09 ] [ -3.193675855946003e-09 -4.797894130413888e-11 -9.81499325955577e-10 ] [ -9.35364810377303e-10 -1.118793205162833e-09 -2.706289722457091e-09 ] [ -2.903919490374067e-10 -6.639120309567111e-10 3.467155869444893e-09 ] [ -4.193518822468443e-09 -3.326823141840966e-09 8.81565642062784e-12 ] [ -2.261163560824372e-09 -2.282982482699412e-09 5.032915015654109e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.50015 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.687751036489312e-18 } }