{ "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" [ [ 2.9239839000000005 0.016485600000000003 -2.5960083000000003 ] [ 0.8487476000000003 -0.043735100000000006 -0.9460531000000002 ] [ 1.8382022000000005 1.1283252000000001 -1.5027579000000004 ] [ 0.26343880000000003 0.8981452000000002 3.428454900000001 ] [ 0.6842633000000001 0.12262870000000002 1.0207238000000003 ] [ -0.36855040000000006 -2.7926929000000005 -2.2087312000000003 ] [ -2.0181004000000002 1.0842401000000002 -0.6597479000000002 ] [ -4.171985000000001 -0.4133970000000001 3.464119600000001 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.684738644175607e-09 2.641284289986049e-11 -4.159263805662753e-09 ] [ 1.35984356168011e-09 -7.007135472835008e-11 -1.515744158855365e-09 ] [ 2.945124589143127e-09 1.807776256099484e-09 -2.407683574102505e-09 ] [ 4.220754863716071e-10 1.43898724152374e-09 5.492990286247203e-09 ] [ 1.096310661731457e-09 1.96472836179097e-10 1.635379808654136e-09 ] [ -5.904828344664885e-10 -4.474387273454153e-09 -3.53877749027153e-09 ] [ -3.233353279307129e-09 1.737144139553854e-09 -1.057032661001897e-09 ] [ -6.68425682932829e-09 -6.623350085088578e-10 5.550131434775049e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -32.784165 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.252602269544964e-18 } }