{ "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" [ [ 0.21291020000000005 -0.9009521000000003 0.38812390000000013 ] [ -0.8300519000000002 0.4679374000000001 1.1645876000000002 ] [ 0.04806160000000002 0.10947440000000003 -0.6532295000000001 ] [ -0.34417440000000005 1.7109917000000003 -1.5153034000000005 ] [ -0.3922862000000001 -0.24104080000000006 0.17800590000000002 ] [ -1.8067122000000004 0.028487500000000006 -0.17075580000000004 ] [ 0.6972715000000002 -1.8787156000000005 -1.0948157000000003 ] [ 2.4149813000000004 0.7038173000000001 1.7033870000000004 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.411197447698522e-10 -1.443484391080664e-09 6.218430385537173e-10 ] [ -1.32988974823062e-09 7.497183622779381e-10 1.865875025593582e-09 ] [ 7.700317187824132e-11 1.753973242561076e-10 -1.046589032916874e-09 ] [ -5.514281771578676e-10 2.741310900122848e-09 -2.427783680898752e-09 ] [ -6.285117783024731e-10 -3.861899344189288e-10 2.851968913444627e-10 ] [ -2.894672047354134e-09 4.564200648504001e-11 -2.735809506260007e-10 ] [ 1.117152095650147e-09 -3.010034211452245e-09 -1.754088118624787e-09 ] [ 3.869226578529191e-09 1.12763962337458e-09 2.72912682757465e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.956909 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.760931895603312e-18 } }