{ "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" [ [ -1.8055715 -0.7871102 -1.2258162 ] [ 2.1260431 1.204433 1.9453758 ] [ -1.4245074 2.3815199 -2.420753 ] [ -0.1490744 -0.0011822 1.380707 ] [ -1.3218574 -1.6677602 -4.0782625 ] [ 2.1013327 -0.1645449 -1.8962291 ] [ -0.9856812 0.4796208 4.5597713 ] [ 1.4593162 -1.4449762 1.7352067 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.892844444482787e-09 -1.261089560433212e-09 -1.963974057037897e-09 ] [ 3.406296549633157e-09 1.929714393920007e-09 3.116835625430097e-09 ] [ -2.282312452436594e-09 3.815615505749954e-09 -3.878473861331463e-09 ] [ -2.388435184397875e-10 -1.89409320110976e-12 2.212136475574905e-09 ] [ -2.117849022311474e-09 -2.672046401540732e-09 -6.53409683098536e-09 ] [ 3.36670612446254e-09 -2.636299918518739e-10 -3.038093931700625e-09 ] [ -1.579235374202089e-09 7.684372326093927e-10 7.305558973054824e-09 ] [ 2.338082297994697e-09 -2.315107085252425e-09 2.780107606995519e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -32.719491 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.242240352467601e-18 } }