{ "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" [ 5.4207 0 0 ] "si-unit" "m" "si-value" [ 5.420700000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.121917 5.37017 0 ] "si-unit" "m" "si-value" [ -1.21917e-11 5.37017e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0328689 -0.300504 5.4102 ] "si-unit" "m" "si-value" [ -3.28689e-12 -3.00504e-11 5.4102e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0512752 -0.33658 -0.135216 ] [ 1.26577 1.35967 1.6251 ] [ 0.0338464 2.52642 2.69707 ] [ 1.45988 3.83229 4.06608 ] [ 2.77794 -0.093605 2.9072 ] [ 4.03914 1.38604 3.72159 ] [ 2.13334 2.58123 0.377362 ] [ 4.24352 4.40881 1.44889 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.12752e-12 -3.3658e-11 -1.35216e-11 ] [ 1.26577e-10 1.35967e-10 1.6251e-10 ] [ 3.38464e-12 2.52642e-10 2.69707e-10 ] [ 1.45988e-10 3.83229e-10 4.06608e-10 ] [ 2.77794e-10 -9.3605e-12 2.9072e-10 ] [ 4.03914e-10 1.38604e-10 3.72159e-10 ] [ 2.13334e-10 2.58123e-10 3.77362e-11 ] [ 4.243520000000001e-10 4.40881e-10 1.44889e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.7421563999999999 5.452361099999999 -1.6451064999999998 ] [ -0.5819439999999999 -6.983700999999999 0.06396389999999999 ] [ -0.8703050999999999 4.917904799999999 0.04875929999999999 ] [ -0.7253151999999999 -2.4432746999999995 0.3661557999999999 ] [ -1.0412319999999997 0.5980699999999999 -2.7941535999999996 ] [ -0.5119952999999999 -1.0190826999999998 4.9893032999999996 ] [ 5.232523999999999 3.9321240999999993 -4.071693499999999 ] [ -2.2438887999999997 -4.454401599999999 3.0427711999999993 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.189065633057093e-09 8.73564548257937e-09 -2.635751173026115e-09 ] [ -9.323770714148352e-10 -1.118912246885758e-08 1.024814651551891e-10 ] [ -1.394382484183006e-09 7.879352093880098e-09 7.812101050657343e-11 ] [ -1.162083056150876e-09 -3.914557602532133e-09 5.866462623303205e-10 ] [ -1.668237567228825e-09 9.58213771601856e-10 -4.476727572844154e-09 ] [ -8.203068996194821e-10 -1.63275047660174e-09 7.993745101340287e-09 ] [ 8.383427620574897e-09 6.299957303104241e-09 -6.523572132763324e-09 ] [ -3.595106175034967e-09 -7.136738103174112e-09 4.87505687908356e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -19.337203 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.098161455826362e-18 } }