{ "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" [ 5.36838 0 0 ] "si-unit" "m" "si-value" [ 5.368380000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0320632 5.46183 0 ] "si-unit" "m" "si-value" [ -3.20632e-12 5.46183e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0835799 0.195471 5.46165 ] "si-unit" "m" "si-value" [ -8.35799e-12 1.95471e-11 5.461649999999999e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0445787 0.0905296 0.00673122 ] [ 1.23056 1.45848 1.40837 ] [ -0.162897 2.78891 2.76222 ] [ 1.2265 4.23635 3.86532 ] [ 2.68005 0.105406 2.5782 ] [ 3.88338 1.64051 4.20954 ] [ 2.69942 2.77008 0.000613011 ] [ 4.15957 4.14184 1.16379 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.45787e-12 9.05296e-12 6.731220000000001e-13 ] [ 1.23056e-10 1.45848e-10 1.40837e-10 ] [ -1.62897e-11 2.78891e-10 2.76222e-10 ] [ 1.2265e-10 4.23635e-10 3.86532e-10 ] [ 2.68005e-10 1.05406e-11 2.5782e-10 ] [ 3.88338e-10 1.64051e-10 4.20954e-10 ] [ 2.69942e-10 2.77008e-10 6.13011e-14 ] [ 4.159570000000001e-10 4.14184e-10 1.16379e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.2366868000000006 0.20002870000000006 -1.7906050000000004 ] [ 0.5131801000000001 0.24383490000000005 -0.6630189000000001 ] [ 1.2692268000000002 0.8232205000000002 -1.1076468000000002 ] [ 0.24561240000000006 0.7252989000000001 2.2015444000000004 ] [ 0.6096215000000001 0.059979100000000014 0.7059598000000001 ] [ -0.08729290000000002 -2.0006600000000003 -1.7445483000000004 ] [ -1.8287106000000004 0.8779666000000003 -0.20132810000000007 ] [ -2.9583240000000006 -0.9296688000000002 2.5996429000000005 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.583567299011966e-09 3.204813066290171e-10 -2.868865468087585e-09 ] [ 8.222051584798064e-10 3.90666576115106e-10 -1.062273380728533e-09 ] [ 2.033525505452798e-09 1.318944638863287e-09 -1.774645807063934e-09 ] [ 3.935144450585781e-10 1.162056940671957e-09 3.527262967333164e-09 ] [ 9.767213148370275e-10 9.609711175662531e-11 1.131072286784644e-09 ] [ -1.398586435418324e-10 -3.205410678169729e-09 -2.795074500116385e-09 ] [ -2.929917369529141e-09 1.406657560363266e-09 -3.225631749300846e-10 ] [ -4.73975754955154e-09 -1.489493616447191e-09 4.165087076808713e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.401559 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.671955016967183e-18 } }