{ "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" [ 5.39198 0 0 ] "si-unit" "m" "si-value" [ 5.39198e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0815956 5.53401 0 ] "si-unit" "m" "si-value" [ 8.15956e-12 5.534010000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.109849 -0.0410552 5.55668 ] "si-unit" "m" "si-value" [ -1.09849e-11 -4.10552e-12 5.55668e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0600222 -0.0188866 -0.0475744 ] [ 1.35953 1.30974 1.45574 ] [ -0.0201429 2.70129 2.75612 ] [ 1.43727 3.87805 4.08993 ] [ 2.67575 -0.0837777 2.76281 ] [ 3.98871 1.3119 4.2787 ] [ 2.73779 2.77507 0.256836 ] [ 4.26747 4.05038 1.42682 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -6.00222e-12 -1.88866e-12 -4.75744e-12 ] [ 1.35953e-10 1.30974e-10 1.45574e-10 ] [ -2.01429e-12 2.70129e-10 2.75612e-10 ] [ 1.43727e-10 3.87805e-10 4.08993e-10 ] [ 2.67575e-10 -8.37777e-12 2.76281e-10 ] [ 3.98871e-10 1.3119e-10 4.2787e-10 ] [ 2.73779e-10 2.77507e-10 2.56836e-11 ] [ 4.26747e-10 4.05038e-10 1.42682e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.4577252000000005 -1.1599777000000002 1.4636241000000003 ] [ -0.8022452000000002 -0.24070690000000006 -0.6326415000000001 ] [ 1.1204269000000002 -2.3634214000000004 1.8719684000000005 ] [ 0.21112790000000006 1.6452333000000003 0.4069153000000001 ] [ 0.6606651000000001 -0.7329365000000001 1.0193645000000002 ] [ -1.5920124000000004 1.4948919000000003 -1.5518995000000004 ] [ 0.18859590000000007 -1.0669337000000003 -1.8390003000000004 ] [ -2.2442833000000006 2.4238510000000004 -0.7383310000000001 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.937709855791005e-09 -1.858489151589357e-09 2.344984314659442e-09 ] [ -1.28533850358902e-09 -3.856549676452436e-10 -1.013603420647843e-09 ] [ 1.79512178449542e-09 -3.786618512178406e-09 2.999224005356384e-09 ] [ 3.382641853786004e-10 2.635954329021633e-09 6.519501803058185e-10 ] [ 1.058502177398494e-09 -1.17429372483098e-09 1.633201969973482e-09 ] [ -2.550685047303699e-09 2.395080852803292e-09 -2.48641709673121e-09 ] [ 3.021639417587349e-10 -1.709416230083641e-09 -2.946403286304187e-09 ] [ -3.595738233711874e-09 3.883437404502702e-09 -1.182936666611885e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.994342 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.606711661267952e-18 } }