{ "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" [ 5.45078 0 0 ] "si-unit" "m" "si-value" [ 5.45078e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.124172 5.56718 0 ] "si-unit" "m" "si-value" [ 1.24172e-11 5.56718e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0770044 0.0388551 5.42613 ] "si-unit" "m" "si-value" [ -7.70044e-12 3.88551e-12 5.42613e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.041219 -0.09108 -0.141264 ] [ 1.43794 1.32483 1.35293 ] [ -0.00716544 2.71531 2.76218 ] [ 1.33045 4.09617 4.06457 ] [ 2.76499 -0.0409375 2.74385 ] [ 3.91349 1.4388 4.06995 ] [ 2.74821 2.70058 0.127143 ] [ 4.06928 4.06454 1.39302 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.1219e-12 -9.108e-12 -1.41264e-11 ] [ 1.43794e-10 1.32483e-10 1.35293e-10 ] [ -7.165440000000001e-13 2.71531e-10 2.76218e-10 ] [ 1.33045e-10 4.09617e-10 4.06457e-10 ] [ 2.76499e-10 -4.09375e-12 2.74385e-10 ] [ 3.91349e-10 1.4388e-10 4.069950000000001e-10 ] [ 2.74821e-10 2.70058e-10 1.27143e-11 ] [ 4.06928e-10 4.06454e-10 1.39302e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.4786027000000001 0.5409476000000001 2.0134192000000004 ] [ -1.8024869000000003 -0.7700924000000002 0.4312669000000001 ] [ -0.03665890000000001 -0.4561465000000001 -0.6519468000000002 ] [ 1.3101414000000002 0.19531460000000006 -0.18389140000000004 ] [ -1.7732709000000004 -0.6104814000000001 0.08773430000000002 ] [ 1.5031390000000004 -0.32556310000000005 0.3020145000000001 ] [ -0.36372080000000007 0.5662676000000001 -1.5591497000000005 ] [ 1.6414596000000004 0.8597534000000002 -0.4394470000000001 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.668060565917563e-10 8.666935977978703e-10 3.22585317010984e-09 ] [ -2.887902370478268e-09 -1.233824039135762e-09 6.909657445048917e-10 ] [ -5.873403252424514e-11 -7.308272579597474e-10 -1.044533920965374e-09 ] [ 2.099077921022181e-09 3.129284858209038e-10 -2.946265018461812e-10 ] [ -2.841093178324976e-09 -9.780990265132532e-10 1.405658443022535e-10 ] [ 2.408294163612692e-09 -5.216095874151725e-10 4.838805710426018e-10 ] [ -5.827449622586727e-10 9.072607098365262e-10 -2.498033197667335e-09 ] [ 2.62990819510772e-09 1.377476797133311e-09 -7.040717094806978e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -36.309483 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.817420477593505e-18 } }