{ "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" [ [ -0.6300007000000001 0.6254469000000001 3.097214000000001 ] [ -2.3075281000000003 -1.0226998000000003 0.4473029000000001 ] [ -0.22216660000000005 -0.36988990000000005 -1.0098584000000002 ] [ 1.5947795000000005 0.5232070000000001 -0.07471070000000002 ] [ -3.000082900000001 -0.6900656000000001 -0.10725990000000003 ] [ 2.7194704000000005 -0.9525550000000003 0.34564980000000006 ] [ -0.8832090000000002 0.6567920000000002 -2.0386241000000003 ] [ 2.7287374000000004 1.2297645000000001 -0.6597136000000001 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.009372392627635e-09 1.002076400731836e-09 4.962283860414452e-09 ] [ -3.697067573659045e-09 -1.638545709656836e-09 7.166582487960405e-10 ] [ -3.559501324426254e-10 -5.9262895005005e-10 -1.617971518798495e-09 ] [ 2.555118430231114e-09 8.382700232389057e-10 -1.196997368636026e-10 ] [ -4.806662682841867e-09 -1.105606971138325e-09 -1.71849304129346e-10 ] [ 4.357071895837626e-09 -1.526161351026144e-09 5.537920285441959e-10 ] [ -1.415056811080147e-09 1.052296787128474e-09 -3.266235871619442e-09 ] [ 4.371919266582578e-09 1.970299930989802e-09 -1.056977706343803e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.920554 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.755107182498393e-18 } }