{ "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" [ 5.3952 0 0 ] "si-unit" "m" "si-value" [ 5.3952e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00461172 5.6034 0 ] "si-unit" "m" "si-value" [ 4.61172e-13 5.6034e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.071329 0.0469434 5.27588 ] "si-unit" "m" "si-value" [ 7.132900000000001e-12 4.694340000000001e-12 5.27588e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0148313 -0.0405976 0.0741579 ] [ 1.40662 1.33729 1.44565 ] [ 0.021393 2.68696 2.73819 ] [ 1.3197 4.02815 4.06112 ] [ 2.69728 0.0386556 2.72588 ] [ 4.00631 1.34667 3.9586 ] [ 2.7243 2.85873 -0.0805011 ] [ 4.14392 4.06243 1.15826 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.48313e-12 -4.05976e-12 7.41579e-12 ] [ 1.40662e-10 1.33729e-10 1.44565e-10 ] [ 2.1393e-12 2.68696e-10 2.73819e-10 ] [ 1.3197e-10 4.02815e-10 4.06112e-10 ] [ 2.69728e-10 3.86556e-12 2.72588e-10 ] [ 4.00631e-10 1.34667e-10 3.9586e-10 ] [ 2.7243e-10 2.85873e-10 -8.050110000000001e-12 ] [ 4.14392e-10 4.06243e-10 1.15826e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.5834793000000001 0.9763252000000002 -0.9756929000000002 ] [ 0.17631400000000003 1.4134163000000002 -2.4046739000000006 ] [ -0.6341799000000001 0.5542177000000001 -1.6696762000000005 ] [ 0.6104477000000001 3.126684000000001 -1.6447913000000005 ] [ 0.14495310000000003 -3.778646900000001 -0.6771937000000001 ] [ 1.1546986000000001 0.010122300000000002 1.3095482000000003 ] [ -1.0772720000000002 -3.259646500000001 2.0715091000000005 ] [ -0.9584407000000003 0.9575278000000003 3.990970800000001 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.348369008826763e-10 1.564245422625377e-09 -1.563232366339699e-09 ] [ 2.82486171047076e-10 2.264542569974734e-09 -3.852712334969653e-09 ] [ -1.016068217532457e-09 8.87954649089222e-10 -2.675116193985911e-09 ] [ 9.78045041219042e-10 5.009500046701656e-09 -2.635246188666485e-09 ] [ 2.322404698458654e-10 -6.054059771316535e-09 -1.084983922832006e-09 ] [ 1.850031116232512e-09 1.62177125423382e-11 2.098127527136759e-09 ] [ -1.725980026862448e-09 -5.222529457399882e-09 3.31892347713837e-09 ] [ -1.535591294614604e-09 1.534128667565426e-09 6.394240162736288e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.404353 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.67240271184878e-18 } }