{ "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" [ [ 0.9261654000000002 0.8819973000000002 -1.2256465000000003 ] [ -0.6758142000000001 1.1966440000000003 -1.9082256000000004 ] [ -0.4581297000000001 0.17185300000000003 -1.6723132000000005 ] [ 3.226442900000001 3.396191000000001 -4.946932500000001 ] [ 0.060504900000000014 -3.510565700000001 -0.8767080000000003 ] [ 1.4252405000000001 0.5732041000000001 1.4851551000000003 ] [ -0.10671190000000003 -3.717702800000001 1.8637025000000005 ] [ -4.397698000000001 1.0083791000000002 7.280968200000002 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.483880563099264e-09 1.413115465311089e-09 -1.963702183843881e-09 ] [ -1.082773720165403e-09 1.917235056016296e-09 -3.057314468720631e-09 ] [ -7.340047006814299e-10 2.75338861082802e-10 -2.67934113376977e-09 ] [ 5.1693314253152e-09 5.441297864801095e-09 -7.925859661475205e-09 ] [ 9.693953702250662e-11 -5.624546336661854e-09 -1.404641072440872e-09 ] [ 2.283487026930477e-09 9.183742155329995e-10 2.379480799085934e-09 ] [ -1.709713127497446e-10 -5.956416558316376e-09 2.985980598227386e-09 ] [ -7.045888978988533e-09 1.61560143223395e-09 1.166539712293704e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -34.985571 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.605306438334801e-18 } }