{ "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" [ [ 0.7573363000000002 1.2581137000000002 1.7103981000000004 ] [ -1.1116795000000002 -0.8027173000000002 0.4914484000000001 ] [ 0.31330050000000004 -1.3391889000000001 0.26885700000000007 ] [ 0.8914888000000002 -0.5634091000000001 -0.34621710000000006 ] [ -1.1654458000000003 0.3878147000000001 0.17171720000000001 ] [ -0.28422830000000004 1.3358820000000002 -0.39432050000000013 ] [ 0.9143410000000002 0.4580879000000001 -0.8508992000000002 ] [ -0.31511310000000003 -0.7345831000000002 -1.0509837000000002 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.213386513943175e-09 2.015720356448185e-09 2.740359848080741e-09 ] [ -1.781106904722634e-09 -1.2860948911717e-09 7.873871368095668e-10 ] [ 5.019627363849505e-10 -2.145617146414869e-09 4.307563997384257e-10 ] [ 1.428322513065047e-09 -9.026808879659695e-10 -5.547009433411758e-10 ] [ -1.867250013569553e-09 6.213476455425659e-10 2.751212832292378e-10 ] [ -4.553839372297287e-10 2.140318908547546e-09 -6.317710862021667e-10 ] [ 1.464935773638893e-09 7.339377236513685e-10 -1.363290804897424e-09 ] [ -5.048668417278125e-10 -1.176931868854789e-09 -1.683861512981881e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.214934240654237 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.758136516898562e-18 } }