{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.52526e-10 0.0 0.0 ] "source-value" [ 5.52526 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 1.63004e-11 5.510640000000001e-10 0.0 ] "source-value" [ 0.163004 5.51064 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 9.29221e-12 -5.43858e-12 5.47616e-10 ] "source-value" [ 0.0929221 -0.0543858 5.47616 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -3.637363583408567e-09 5.200501889101479e-10 -1.14072508048964e-09 ] [ -1.316450210082363e-09 1.277063101124926e-09 -3.094674158193529e-09 ] [ -2.233670210011444e-09 -2.491855685270515e-10 -1.035399110961882e-09 ] [ 2.543470926633222e-09 8.343063984967084e-10 1.565045536742312e-09 ] [ -1.387150579352039e-09 -3.887628217889728e-09 8.746592995211636e-10 ] [ 2.108071419047718e-09 2.129520558558678e-09 4.471041287799274e-09 ] [ -1.511428055256591e-09 -4.411716052101953e-09 -6.031859321309943e-09 ] [ 5.434520292430065e-09 3.787589751645934e-09 4.391911546892244e-09 ] ] "source-value" [ [ -2.2702638 0.3245898 -0.7119845999999999 ] [ -0.8216636 0.7970801 -1.9315436999999995 ] [ -1.3941473 -0.1555294 -0.6462452999999999 ] [ 1.5875097 0.5207331 0.9768245999999998 ] [ -0.8657913 -2.4264667 0.5459193999999999 ] [ 1.3157547 1.3291422 2.7906044999999997 ] [ -0.9433592 -2.7535766 -3.7647904999999993 ] [ 3.3919608 2.3640276 2.7412155999999994 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 5.15746e-12 -3.81365e-12 -7.29456e-13 ] [ 1.44408e-10 1.32704e-10 1.45073e-10 ] [ 7.917670000000001e-12 2.70101e-10 2.71983e-10 ] [ 1.48556e-10 4.06547e-10 4.00394e-10 ] [ 2.80111e-10 1.1527e-12 2.65388e-10 ] [ 4.15958e-10 1.27318e-10 3.97985e-10 ] [ 2.73428e-10 2.80936e-10 1.00172e-11 ] [ 4.136790000000001e-10 4.02299e-10 1.21489e-10 ] ] "source-value" [ [ 0.0515746 -0.0381365 -0.00729456 ] [ 1.44408 1.32704 1.45073 ] [ 0.0791767 2.70101 2.71983 ] [ 1.48556 4.06547 4.00394 ] [ 2.80111 0.011527 2.65388 ] [ 4.15958 1.27318 3.97985 ] [ 2.73428 2.80936 0.100172 ] [ 4.13679 4.02299 1.21489 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.322678430803175e-18 "source-value" -33.221546 } }