{ "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" [ [ -2.5650582 -2.0478495 -2.493256 ] [ 4.2370028 2.3497562 2.4998632 ] [ -2.0650248 2.1628906 -2.411743 ] [ -0.9767599 0.6123427 0.9453897 ] [ -1.9527377 -1.4484141 -5.1270445 ] [ 4.6375606 -1.3887704 -1.725271 ] [ -2.3468409 1.4907093 6.3139503 ] [ 1.0318582 -1.7306648 1.9981112 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.109676312890099e-09 -3.281016618848583e-09 -3.994636505780304e-09 ] [ 6.788426884352574e-09 3.76472447923663e-09 4.005222407236468e-09 ] [ -3.308534483190523e-09 3.46533278121824e-09 -3.864038281813062e-09 ] [ -1.564941888808177e-09 9.810811659404717e-10 1.51468128736427e-09 ] [ -3.128630715270901e-09 -2.320615227376139e-09 -8.214430899378213e-09 ] [ 7.430191232079019e-09 -2.225055484870833e-09 -2.764188883517814e-09 ] [ -3.76005365369553e-09 2.388379608546496e-09 1.011606363889729e-08 ] [ 1.653219097641299e-09 -2.772830703846283e-09 3.201327076773701e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.830666 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.580487921185824e-18 } }