{ "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" [ 5.54387 0 0 ] "si-unit" "m" "si-value" [ 5.543870000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0557634 5.4256 0 ] "si-unit" "m" "si-value" [ 5.57634e-12 5.4256e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.136783 0.0146252 5.57946 ] "si-unit" "m" "si-value" [ -1.36783e-11 1.46252e-12 5.57946e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00414448 -0.00753772 -0.01957 ] [ 1.42138 1.28295 1.34172 ] [ -0.029535 2.68233 2.78427 ] [ 1.30944 3.95933 4.27313 ] [ 2.73162 -0.0222546 2.83084 ] [ 4.1911 1.38332 4.19541 ] [ 2.73336 2.72737 0.0657353 ] [ 3.99828 4.07749 1.28506 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.14448e-13 -7.537720000000001e-13 -1.957e-12 ] [ 1.42138e-10 1.28295e-10 1.34172e-10 ] [ -2.9535e-12 2.68233e-10 2.78427e-10 ] [ 1.30944e-10 3.95933e-10 4.27313e-10 ] [ 2.73162e-10 -2.22546e-12 2.83084e-10 ] [ 4.1911e-10 1.38332e-10 4.19541e-10 ] [ 2.73336e-10 2.72737e-10 6.57353e-12 ] [ 3.99828e-10 4.07749e-10 1.28506e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.07256600000000002 -0.8823707000000002 0.4188976000000001 ] [ -0.6476237000000001 0.35521110000000006 1.0086468000000002 ] [ 0.022504700000000002 0.26217290000000004 -0.9802728000000003 ] [ -0.4341526000000001 1.3707836000000002 -1.3486597000000002 ] [ -0.25215860000000007 -0.15787210000000002 0.4041309000000001 ] [ -1.5113274000000005 0.27199750000000006 -0.18366370000000004 ] [ 0.6296191000000001 -1.8591123000000005 -0.9151154000000002 ] [ 2.1205725000000006 0.6391900000000001 1.5960364000000005 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.16263549622844e-10 -1.413713718066224e-09 6.711479467586785e-10 ] [ -1.037607559764626e-09 5.691109245574374e-10 1.616030334918871e-09 ] [ 3.60565044951798e-11 4.200472944480186e-10 -1.570570175105756e-09 ] [ -6.955891513103485e-10 2.196237454190403e-09 -2.16079105855745e-09 ] [ -4.040026169821524e-10 -2.529389897805114e-10 6.474890850573908e-10 ] [ -2.421413446603972e-09 4.357880390064151e-10 -2.942616886539859e-10 ] [ 1.008761010340109e-09 -2.978626287041999e-09 -1.466176511293564e-09 ] [ 3.397531710202966e-09 1.02409528268646e-09 2.557132227093478e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -26.00419807419016 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.166331854037527e-18 } }