{ "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" [ 5.42802 0 0 ] "si-unit" "m" "si-value" [ 5.42802e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0476613 5.42825 0 ] "si-unit" "m" "si-value" [ -4.76613e-12 5.42825e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0987222 -0.186163 5.49756 ] "si-unit" "m" "si-value" [ -9.87222e-12 -1.86163e-11 5.49756e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0306296 -0.063852 -0.0490719 ] [ 1.36252 1.37203 1.3263 ] [ 0.0367903 2.58342 2.70389 ] [ 1.37777 4.04701 4.07282 ] [ 2.72906 0.000401884 2.69217 ] [ 4.00266 1.36136 4.06132 ] [ 2.83534 2.75342 0.0381881 ] [ 4.01886 4.16847 1.28111 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.06296e-12 -6.385200000000001e-12 -4.907190000000001e-12 ] [ 1.36252e-10 1.37203e-10 1.3263e-10 ] [ 3.67903e-12 2.58342e-10 2.70389e-10 ] [ 1.37777e-10 4.04701e-10 4.07282e-10 ] [ 2.72906e-10 4.01884e-14 2.69217e-10 ] [ 4.00266e-10 1.36136e-10 4.06132e-10 ] [ 2.83534e-10 2.75342e-10 3.818810000000001e-12 ] [ 4.01886e-10 4.16847e-10 1.28111e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.5370944999999994 5.921917499999999 -3.094761899999999 ] [ 2.1064996999999996 -2.8183896999999996 -2.6153815999999996 ] [ -2.7331724999999993 5.2147936999999995 0.5941977999999999 ] [ 0.28491809999999995 -2.7959429999999994 0.8596676999999998 ] [ -1.2775965999999999 0.6626437999999999 -0.7820788999999998 ] [ 2.8022087999999994 -3.1028550999999993 0.9331721999999998 ] [ -5.783594299999999 -0.4068363999999999 -2.4587829999999995 ] [ 2.0636421999999994 -2.6753308999999996 6.563967699999998 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.064873526149912e-09 9.487957846975693e-09 -4.958355203973443e-09 ] [ 3.374984598868009e-09 -4.515558122846269e-09 -4.190303288513533e-09 ] [ -4.379025116191364e-09 8.355020617270404e-09 9.52009831134205e-10 ] [ 4.564891224236753e-10 -4.47959454459586e-09 1.377339501944521e-09 ] [ -2.046935420197844e-09 1.061672413024969e-09 -1.253028539524422e-09 ] [ 4.489633462949177e-09 -4.971321939907732e-09 1.495106694338375e-09 ] [ -9.266339647995584e-09 -6.518237739406772e-10 -3.939404670676421e-09 ] [ 3.306319313776354e-09 -4.286352656198189e-09 1.051663567527072e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -35.156388 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.632674338943799e-18 } }