{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.47211e-10 0.0 0.0 ] "source-value" [ 5.47211 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.02197e-11 5.35978e-10 0.0 ] "source-value" [ 0.102197 5.35978 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.85088e-12 1.67086e-12 5.27242e-10 ] "source-value" [ 0.0185088 0.0167086 5.27242 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -2.02324177459453e-09 -1.298919033279907e-09 -1.883686423087016e-09 ] [ 3.136246796279399e-09 1.663689468455361e-09 2.103258961131821e-09 ] [ -1.386627148250024e-09 2.513120093817097e-09 -2.12890756578356e-09 ] [ -1.063458030121953e-09 2.45329289618448e-10 8.136976006233581e-10 ] [ -1.402176913225536e-09 -1.455701949120236e-09 -4.296255193924001e-09 ] [ 3.272856546069574e-09 -9.123516260491182e-10 -1.822057898279633e-09 ] [ -1.51555974832631e-09 9.018910148919149e-10 5.574831390649611e-09 ] [ 9.81960272169381e-10 -1.657057258333559e-09 1.63911912866942e-09 ] ] "source-value" [ [ -1.2628082 -0.8107215 -1.1757046 ] [ 1.9574913 1.0383933 1.312751 ] [ -0.8654646 1.5685662 -1.3287596 ] [ -0.6637583 0.1531225 0.5078701 ] [ -0.87517 -0.9085777 -2.6815116 ] [ 2.0427564 -0.5694451 -1.1372391 ] [ -0.945938 0.5629161 3.4795361 ] [ 0.6128914 -1.0342538 1.0230577 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "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 ] ] "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 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.725587719130801e-18 "source-value" -35.736308 } }