{ "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" [ 5.4 0 0 ] "si-unit" "m" "si-value" [ 5.400000000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.386566 5.8038 0 ] "si-unit" "m" "si-value" [ 3.86566e-11 5.8038e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.433064 -0.220286 5.20849 ] "si-unit" "m" "si-value" [ -4.33064e-11 -2.20286e-11 5.20849e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0990081 -0.244555 -0.290689 ] [ 1.37678 1.31208 1.41317 ] [ 0.146167 2.66383 2.23753 ] [ 1.10278 3.83154 3.71513 ] [ 2.55958 0.422069 2.77183 ] [ 3.95966 1.45431 4.3569 ] [ 2.78855 2.68274 0.381413 ] [ 4.33575 3.68618 1.46711 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -9.90081e-12 -2.44555e-11 -2.90689e-11 ] [ 1.37678e-10 1.31208e-10 1.41317e-10 ] [ 1.46167e-11 2.66383e-10 2.23753e-10 ] [ 1.10278e-10 3.83154e-10 3.71513e-10 ] [ 2.55958e-10 4.22069e-11 2.77183e-10 ] [ 3.95966e-10 1.45431e-10 4.356900000000001e-10 ] [ 2.78855e-10 2.68274e-10 3.81413e-11 ] [ 4.33575e-10 3.68618e-10 1.46711e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.6717231000000004 -6.296995500000002 10.028528700000003 ] [ -6.228714700000002 -1.0334196000000002 -28.068158500000006 ] [ 39.80170970000001 -42.25510860000001 48.19244120000001 ] [ 9.383814800000001 1.8222507000000003 4.530725900000001 ] [ 12.758244900000003 -15.532436600000004 15.825458000000003 ] [ 0.12371490000000003 8.115469500000001 -8.287185900000003 ] [ -6.658738200000002 -0.5333367000000001 -5.897499800000001 ] [ -50.85175450000001 55.71357680000001 -36.32430980000001 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.678395689338046e-09 -1.008889905450315e-08 1.60674743565384e-08 ] [ -9.979501152192323e-09 -1.655720736237627e-09 -4.497014770810849e-08 ] [ 6.376936927459116e-08 -6.770014766605245e-08 7.721280322605892e-08 ] [ 1.503452881034338e-08 2.919567492830144e-09 7.259023172038622e-09 ] [ 2.044096186962967e-08 -2.488570698960641e-08 2.535517902994837e-08 ] [ 1.982131220576466e-10 1.300241560683966e-08 -1.327753561059426e-08 ] [ -1.066847475596322e-08 -8.54499598794668e-10 -9.448836378579673e-09 ] [ -8.147349285780436e-08 8.926299094552451e-08 -5.819796040773723e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -2.7406501 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.391005552189763e-19 } }