{ "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" [ 5.40103 0 0 ] "si-unit" "m" "si-value" [ 5.401030000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.134454 5.44836 0 ] "si-unit" "m" "si-value" [ -1.34454e-11 5.44836e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.122267 -0.177468 5.33534 ] "si-unit" "m" "si-value" [ -1.22267e-11 -1.77468e-11 5.335340000000001e-10 ] } "unrelaxed-configuration-positions" { "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 ] ] "source-unit" "angstrom" "si-unit" "m" "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 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.6904294000000004 2.2782039000000003 3.475882700000001 ] [ -1.2613293000000003 -0.9659607000000002 0.31655440000000007 ] [ 0.4489238000000001 -2.3630957000000006 -0.7570742000000003 ] [ 1.0464022000000002 -0.6129962000000001 -0.3777521000000001 ] [ -2.0276748000000007 0.6465945000000001 -0.7457746000000001 ] [ -0.27626670000000003 1.5041269000000004 -0.3885483000000001 ] [ 0.6940551000000001 0.27067410000000003 -0.6605779000000002 ] [ -0.31453970000000003 -0.7575468000000002 -0.8627101000000003 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.708366463792972e-09 3.650085025995381e-09 5.568977998583182e-09 ] [ -2.02087231559003e-09 -1.547639650151603e-09 5.071760588913716e-10 ] [ 7.192552168806953e-10 -3.786096683253012e-09 -1.212966583450864e-09 ] [ 1.676521140793686e-09 -9.82128180279241e-10 -6.052255830781038e-10 ] [ -3.248693159145317e-09 1.035958591037866e-09 -1.194862628506472e-09 ] [ -4.426280478455674e-10 2.40987695389638e-09 -6.225230023115848e-10 ] [ 1.111998854767006e-09 4.336677148760814e-10 -1.058362467597161e-09 ] [ -5.039481536534459e-10 -1.213723772121854e-09 -1.382213952748031e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -41.279342 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.613679667440752e-18 } }