{ "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" [ 5.49393 0 0 ] "si-unit" "m" "si-value" [ 5.49393e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.002595 5.45604 0 ] "si-unit" "m" "si-value" [ 2.595e-13 5.45604e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0698117 0.0748179 5.57684 ] "si-unit" "m" "si-value" [ -6.981170000000001e-12 7.48179e-12 5.57684e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0568347 0.000259582 0.0366732 ] [ 1.4042 1.34788 1.25876 ] [ -0.0116956 2.70772 2.89683 ] [ 1.4664 4.01047 4.21293 ] [ 2.72042 0.0465962 2.58375 ] [ 4.04434 1.40284 4.02526 ] [ 2.59741 2.72967 0.138309 ] [ 4.11134 4.10597 1.37335 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.683470000000001e-12 2.59582e-14 3.66732e-12 ] [ 1.4042e-10 1.34788e-10 1.25876e-10 ] [ -1.16956e-12 2.70772e-10 2.89683e-10 ] [ 1.4664e-10 4.01047e-10 4.21293e-10 ] [ 2.72042e-10 4.65962e-12 2.583750000000001e-10 ] [ 4.04434e-10 1.40284e-10 4.02526e-10 ] [ 2.59741e-10 2.72967e-10 1.38309e-11 ] [ 4.11134e-10 4.10597e-10 1.37335e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.7743079 -0.478897 -1.7162899 ] [ -2.225517 -0.1957999 2.0723814 ] [ 0.7348361 0.3744861 -2.0112524 ] [ -1.9155072 2.1529106 -0.7701858 ] [ 0.206591 -0.7626794 1.6032184 ] [ -0.8899235 -0.2328583 2.026265 ] [ 3.2973806 -0.1902226 -1.7551095 ] [ 0.0178321 -0.6669394 0.5509727 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.240578014680744e-09 -7.672775771712576e-10 -2.74979955229517e-09 ] [ -3.565671306592953e-09 -3.137060221349779e-10 3.320321028460773e-09 ] [ 1.177337219539851e-09 5.999928742345709e-10 -3.22238157380789e-09 ] [ -3.06898085281407e-09 3.4493430299925e-09 -1.233973682432145e-09 ] [ 3.309952702676928e-10 -1.221947103845772e-09 2.568639038516383e-09 ] [ -1.425814626000509e-09 -3.730801242192327e-10 3.246434410545312e-09 ] [ 5.282986107199476e-09 -3.0477020246779e-10 -2.811995407843978e-09 ] [ 2.857017371976768e-11 -1.06855471417038e-09 8.827555786390521e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -25.917477 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.152437571952172e-18 } }