{ "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" [ 5.47211 0 0 ] "si-unit" "m" "si-value" [ 5.47211e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.102197 5.35978 0 ] "si-unit" "m" "si-value" [ 1.02197e-11 5.35978e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0185088 0.0167086 5.27242 ] "si-unit" "m" "si-value" [ 1.85088e-12 1.67086e-12 5.27242e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0278677 0.000879346 0.114128 ] [ 1.32251 1.35955 1.26618 ] [ 0.0215185 2.57215 2.76138 ] [ 1.39174 4.08684 3.88021 ] [ 2.74481 0.155651 2.83937 ] [ 4.07982 1.36064 4.14567 ] [ 2.72904 2.76199 -0.16614 ] [ 4.049 4.11184 1.31405 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.78677e-12 8.79346e-14 1.14128e-11 ] [ 1.32251e-10 1.35955e-10 1.26618e-10 ] [ 2.15185e-12 2.57215e-10 2.76138e-10 ] [ 1.39174e-10 4.08684e-10 3.88021e-10 ] [ 2.74481e-10 1.55651e-11 2.83937e-10 ] [ 4.07982e-10 1.36064e-10 4.14567e-10 ] [ 2.72904e-10 2.76199e-10 -1.6614e-11 ] [ 4.049000000000001e-10 4.11184e-10 1.31405e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.2628076 -0.8107208 -1.1757041 ] [ 1.9574904 1.0383926 1.3127505 ] [ -0.8654645 1.5685661 -1.3287595 ] [ -0.6637579 0.1531223 0.5078703 ] [ -0.8751696 -0.9085774 -2.6815109 ] [ 2.0427548 -0.5694444 -1.1372389 ] [ -0.9459371 0.5629152 3.4795349 ] [ 0.6128915 -1.0342537 1.0230576 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.023240829957618e-09 -1.298917922457787e-09 -1.883685637517999e-09 ] [ 3.136245380159314e-09 1.663688360638508e-09 2.103258177371817e-09 ] [ -1.386626999456493e-09 2.513119954304507e-09 -2.128907423105523e-09 ] [ -1.063457398012908e-09 2.453289712043381e-10 8.136979277625701e-10 ] [ -1.402176283907126e-09 -1.455701480460471e-09 -4.29625410779631e-09 ] [ 3.272854009551343e-09 -9.123505120421494e-10 -1.822057592855862e-09 ] [ -1.515558318853721e-09 9.018895803634367e-10 5.574829513967526e-09 ] [ 9.81960440477211e-10 -1.657057111768046e-09 1.639118981956118e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.736308 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.725587766302727e-18 } }