{ "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" [ 5.31945 0 0 ] "si-unit" "m" "si-value" [ 5.31945e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.00383334 5.41695 0 ] "si-unit" "m" "si-value" [ -3.83334e-13 5.416950000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0189848 -0.118491 5.47074 ] "si-unit" "m" "si-value" [ 1.89848e-12 -1.18491e-11 5.47074e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0147515 -0.0960157 0.0381768 ] [ 1.54242 1.27348 1.38773 ] [ -0.0738039 2.51333 2.6891 ] [ 1.45374 4.04036 4.07661 ] [ 2.81495 -0.0309523 2.80877 ] [ 4.27456 1.30079 3.98727 ] [ 2.73206 2.74248 -0.103972 ] [ 3.9224 4.04214 1.39211 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.47515e-12 -9.60157e-12 3.81768e-12 ] [ 1.54242e-10 1.27348e-10 1.38773e-10 ] [ -7.38039e-12 2.51333e-10 2.6891e-10 ] [ 1.45374e-10 4.04036e-10 4.07661e-10 ] [ 2.81495e-10 -3.09523e-12 2.80877e-10 ] [ 4.27456e-10 1.30079e-10 3.98727e-10 ] [ 2.73206e-10 2.74248e-10 -1.03972e-11 ] [ 3.9224e-10 4.04214e-10 1.39211e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.0538181 0.9325343 -0.0191184 ] [ -1.2109177 0.2460991 -0.7235922 ] [ 3.5970427 3.7054019 -2.7604875 ] [ -1.144623 -0.9825518 -0.286067 ] [ -0.5590531 0.3047941 -0.0375322 ] [ -2.8849929 -2.5318275 3.9468822 ] [ 0.1240927 -0.8245599 0.2059548 ] [ 1.0246333 -0.8498903 -0.3260397 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.688402722395876e-09 1.494084653554093e-09 -3.063105350710272e-11 ] [ -1.940104028652908e-09 3.942942244199212e-10 -1.159322505833238e-09 ] [ 5.763097717959308e-09 5.9367082948479e-09 -4.42278853451064e-09 ] [ -1.833888210229959e-09 -1.574221522684957e-09 -4.583298593823936e-10 ] [ -8.957018066057645e-10 4.883339811777772e-10 -6.013321336718977e-11 ] [ -4.622268175553992e-09 -4.056434828398512e-09 6.32360238589167e-09 ] [ 1.988184227519482e-10 -1.321090594229186e-09 3.299759655015398e-10 ] [ 1.641643518153153e-09 -1.361674368904698e-09 -5.223731847926457e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -35.714242 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.722052356199344e-18 } }