{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.401030000000001e-10 0.0 0.0 ] "source-value" [ 5.40103 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -1.34454e-11 5.44836e-10 0.0 ] "source-value" [ -0.134454 5.44836 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -1.22267e-11 -1.77468e-11 5.335340000000001e-10 ] "source-value" [ -0.122267 -0.177468 5.33534 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 2.834507911978163e-09 3.882159027776965e-09 4.471777167521207e-09 ] [ -2.966092915450184e-09 -1.91161700789976e-09 5.77877229249358e-10 ] [ 1.013179805149304e-09 -3.091637873279451e-09 6.859185677140474e-10 ] [ 1.544885348322785e-09 -1.619610385263911e-09 -9.10605413750108e-10 ] [ -2.304270763677644e-09 1.154138663376639e-09 3.660276631697952e-10 ] [ -8.434851081396096e-10 3.033067903641176e-09 -1.456769639620338e-09 ] [ 2.055434950306914e-09 7.194819248725383e-10 -1.813284859757119e-09 ] [ -1.334159228489727e-09 -2.165982093006534e-09 -1.920940714526844e-09 ] ] "source-value" [ [ 1.7691607000000005 2.4230531000000006 2.7910638000000003 ] [ -1.8512896000000005 -1.1931375000000002 0.3606826000000001 ] [ 0.6323771000000001 -1.9296486000000004 0.4281167000000001 ] [ 0.9642416000000003 -1.0108813000000003 -0.5683552000000001 ] [ -1.4382127000000002 0.7203567000000001 0.22845650000000006 ] [ -0.5264620000000001 1.8930921000000005 -0.9092441000000002 ] [ 1.2829016000000002 0.4490653000000001 -1.1317634000000003 ] [ -0.8327167000000002 -1.3518997000000001 -1.1989569000000002 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -1.2652e-11 -1.01854e-11 -4.28595e-12 ] [ 1.30252e-10 1.39257e-10 1.42794e-10 ] [ -1.34723e-11 2.79807e-10 2.80389e-10 ] [ 1.19895e-10 4.084240000000001e-10 4.16214e-10 ] [ 2.70678e-10 2.24968e-12 2.81634e-10 ] [ 3.95472e-10 1.30925e-10 4.227070000000001e-10 ] [ 2.581e-10 2.82078e-10 2.50931e-11 ] [ 3.97059e-10 4.21723e-10 1.58759e-10 ] ] "source-value" [ [ -0.12652 -0.101854 -0.0428595 ] [ 1.30252 1.39257 1.42794 ] [ -0.134723 2.79807 2.80389 ] [ 1.19895 4.08424 4.16214 ] [ 2.70678 0.0224968 2.81634 ] [ 3.95472 1.30925 4.22707 ] [ 2.581 2.82078 0.250931 ] [ 3.97059 4.21723 1.58759 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.771551763116622e-18 "source-value" -36.023193 } }