{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.441410000000001e-10 0.0 0.0 ] "source-value" [ 5.44141 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 3.87259e-12 5.36248e-10 0.0 ] "source-value" [ 0.0387259 5.36248 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -1.84794e-11 -3.14768e-13 5.51994e-10 ] "source-value" [ -0.184794 -0.00314768 5.51994 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 5.072451287254942e-09 2.896929193777517e-10 -1.31788656142291e-09 ] [ -6.291295776074535e-10 -1.321904499952552e-09 5.801502372212871e-10 ] [ 6.386085351490925e-10 4.948340117283629e-10 1.980179753121965e-09 ] [ -3.417319845219585e-09 -2.67138998977919e-09 3.384849172516479e-09 ] [ 1.602392113555497e-09 3.540026547165104e-09 -9.735063872297299e-10 ] [ -1.786564398946065e-09 7.658258449351507e-10 -2.014930803809455e-09 ] [ -5.931825020725364e-10 -5.671083593103129e-10 -3.220046561600736e-09 ] [ -8.872557723315552e-10 -5.299764741643142e-10 1.581191151203099e-09 ] ] "source-value" [ [ 3.1659751 0.1808121 -0.8225600999999999 ] [ -0.3926718 -0.8250679 0.36210129999999996 ] [ 0.3985881 0.3088511 1.2359309999999997 ] [ -2.1329233 -1.6673505 2.1126566999999996 ] [ 1.0001345 2.2095108 -0.6076148999999998 ] [ -1.1150858 0.4779909 -1.2576208999999998 ] [ -0.3702354 -0.3539612 -2.0097949999999996 ] [ -0.5537815 -0.3307853 0.9869018999999999 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -1.39299e-11 -1.33288e-12 1.35909e-12 ] [ 1.42253e-10 1.35934e-10 1.29237e-10 ] [ 1.99653e-12 2.64656e-10 2.62294e-10 ] [ 1.43068e-10 4.14401e-10 3.95964e-10 ] [ 2.73386e-10 -8.042870000000001e-12 2.7169e-10 ] [ 4.04879e-10 1.39288e-10 4.20461e-10 ] [ 2.827650000000001e-10 2.77065e-10 1.03593e-11 ] [ 4.1636e-10 4.04392e-10 1.34337e-10 ] ] "source-value" [ [ -0.139299 -0.0133288 0.0135909 ] [ 1.42253 1.35934 1.29237 ] [ 0.0199653 2.64656 2.62294 ] [ 1.43068 4.14401 3.95964 ] [ 2.73386 -0.0804287 2.7169 ] [ 4.04879 1.39288 4.20461 ] [ 2.82765 2.77065 0.103593 ] [ 4.1636 4.04392 1.34337 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -3.651329276359095e-18 "source-value" -22.789805 } }