{ "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" [ [ 0.025996500000000006 -0.9096031000000002 0.3933035000000001 ] [ -0.6003295000000001 0.35697320000000005 0.9888314000000002 ] [ -0.06019130000000002 0.25210750000000004 -1.0310288000000003 ] [ -0.38558170000000014 1.3736074000000003 -1.2686693000000002 ] [ -0.22060190000000005 -0.22204660000000007 0.37273990000000007 ] [ -1.4390754000000001 0.34271670000000004 -0.11671540000000002 ] [ 0.6852061000000002 -1.8021890000000005 -0.9119861000000002 ] [ 1.9945772000000004 0.6084339000000001 1.5735248000000004 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.165098452262721e-11 -1.457344821027205e-09 6.30141672578813e-10 ] [ -9.618338896765537e-10 5.719341152921626e-10 1.584282550992934e-09 ] [ -9.643709363555908e-11 4.039207424283361e-10 -1.651890238731479e-09 ] [ -6.177699851483195e-10 2.200761662437874e-09 -2.032632291986702e-09 ] [ -3.534432066840596e-10 -3.557578712481294e-10 5.9719515341933e-10 ] [ -2.305652961448409e-09 5.490926842977275e-10 -1.869986851673203e-10 ] [ 1.097821193849547e-09 -2.887425082062932e-09 -1.461162807914571e-09 ] [ 3.195664958220727e-09 9.748185698821652e-10 2.521064646808996e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.423080038775918 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.791485150045393e-18 } }