{ "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" [ [ 2.596486 2.1995394 -1.7079013 ] [ -0.0712932 0.6545983 -0.1359798 ] [ 2.865312 0.9847771 -0.8716774 ] [ -1.621855 -0.2753329 -0.389244 ] [ -0.7011927 -0.4822788 -1.5109761 ] [ 0.047559699999999996 -0.4543499 1.8740804 ] [ -2.0967025 -1.7493377 -0.070184 ] [ -1.0183143 -0.8776155 2.8118823 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.160029165434509e-09 3.52405060320846e-09 -2.736359533493927e-09 ] [ -1.142242982620186e-10 1.048782092275425e-09 -2.178636564610599e-10 ] [ 4.59073589769769e-09 1.577786846319224e-09 -1.39658115115973e-09 ] [ -2.598498163327584e-09 -4.411319353170643e-10 -6.236376365866751e-10 ] [ -1.123434550615628e-09 -7.726958180674792e-10 -2.420850582007563e-09 ] [ 7.619903943226176e-11 -7.279487874428179e-10 3.002607802379512e-09 ] [ -3.359287726272912e-09 -2.802747964824044e-09 -1.124471639542272e-10 ] [ -1.631519364086317e-09 -1.406095036151702e-09 4.505132081501332e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.659204 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.713234296513785e-18 } }