{ "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" [ 5.54692 0 0 ] "si-unit" "m" "si-value" [ 5.54692e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.123956 5.52099 0 ] "si-unit" "m" "si-value" [ 1.23956e-11 5.520990000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.202669 -0.109883 5.46638 ] "si-unit" "m" "si-value" [ 2.02669e-11 -1.09883e-11 5.466380000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.000314992 -0.0047744 0.0104344 ] [ 1.40487 1.33719 1.19876 ] [ 0.131099 2.68123 2.80213 ] [ 1.67848 4.08836 4.2255 ] [ 2.84099 -0.0865799 2.6392 ] [ 4.04763 1.27038 4.03721 ] [ 2.8307 2.64898 -0.0339665 ] [ 4.22323 4.11032 1.34741 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.14992e-14 -4.7744e-13 1.04344e-12 ] [ 1.40487e-10 1.33719e-10 1.19876e-10 ] [ 1.31099e-11 2.68123e-10 2.80213e-10 ] [ 1.67848e-10 4.08836e-10 4.225500000000001e-10 ] [ 2.84099e-10 -8.65799e-12 2.639200000000001e-10 ] [ 4.04763e-10 1.27038e-10 4.03721e-10 ] [ 2.8307e-10 2.64898e-10 -3.39665e-12 ] [ 4.22323e-10 4.11032e-10 1.34741e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.9661924 0.1485671 -0.3532231 ] [ 0.0508323 0.0929359 2.4325662 ] [ -0.2919549 0.1686874 -0.4738277 ] [ -0.2267625 -1.1135026 -2.0100413 ] [ -1.9088983 0.4410263 0.5994223 ] [ 3.9674344 -0.8268143 -0.7835233 ] [ -1.0282831 2.3377077 1.2190951 ] [ 1.4038245 -1.2486076 -0.6304683 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.150187521228381e-09 2.380307362011414e-10 -5.659257974090454e-10 ] [ 8.144232331247819e-11 1.488997274397606e-10 3.897400726298171e-09 ] [ -4.677633189618066e-10 2.702670107302116e-10 -7.591556694819617e-10 ] [ -3.633135789674249e-10 -1.784027847618248e-09 -3.220441204234984e-09 ] [ -3.058392252942322e-09 7.06602032839474e-10 9.60380402958538e-10 ] [ 6.356530692607809e-09 -1.324702552117066e-09 -1.255342723454572e-09 ] [ -1.647491155957085e-09 3.745420654061882e-09 1.953205683843893e-09 ] [ 2.249174812136733e-09 -2.000489921754818e-09 -1.010121578737702e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.583247 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.70106469052506e-18 } }