{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.49393e-10 0.0 0.0 ] "source-value" [ 5.49393 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 2.595e-13 5.45604e-10 0.0 ] "source-value" [ 0.002595 5.45604 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -6.981170000000001e-12 7.48179e-12 5.57684e-10 ] "source-value" [ -0.0698117 0.0748179 5.57684 ] } "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" [ [ 1.586817354624701e-09 -9.053469098629805e-10 -3.748136312576396e-09 ] [ -5.652596878164029e-09 -1.249578241848088e-09 4.814028048985345e-09 ] [ 1.846650027667616e-09 1.076927528973018e-09 -4.12393020355594e-09 ] [ -4.282805562063034e-09 4.864187552670391e-09 -2.132855328977211e-09 ] [ 6.691831920391431e-10 -1.728268081074622e-09 3.417439688030821e-09 ] [ -2.005212481080668e-09 -9.28980296761077e-10 4.309732223005185e-09 ] [ 7.828916214727964e-09 2.795546661566535e-10 -3.747160426796667e-09 ] [ 9.048292465968001e-12 -1.408496218253295e-09 1.210882311884865e-09 ] ] "source-value" [ [ 0.9904135 -0.5650731 -2.3394027 ] [ -3.5280735 -0.7799254 3.00468 ] [ 1.1525883 0.6721653 -2.5739548 ] [ -2.673117 3.0359871 -1.3312236 ] [ 0.4176713 -1.0787001 2.1329981 ] [ -1.2515552 -0.5798239 2.6899233 ] [ 4.8864252 0.1744843 -2.3387936 ] [ 0.0056475 -0.8791142 0.7557733 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ -5.683470000000001e-12 2.59582e-14 3.66732e-12 ] [ 1.4042e-10 1.34788e-10 1.25876e-10 ] [ -1.16956e-12 2.70772e-10 2.89683e-10 ] [ 1.4664e-10 4.01047e-10 4.21293e-10 ] [ 2.72042e-10 4.65962e-12 2.583750000000001e-10 ] [ 4.04434e-10 1.40284e-10 4.02526e-10 ] [ 2.59741e-10 2.72967e-10 1.38309e-11 ] [ 4.11134e-10 4.10597e-10 1.37335e-10 ] ] "source-value" [ [ -0.0568347 0.000259582 0.0366732 ] [ 1.4042 1.34788 1.25876 ] [ -0.0116956 2.70772 2.89683 ] [ 1.4664 4.01047 4.21293 ] [ 2.72042 0.0465962 2.58375 ] [ 4.04434 1.40284 4.02526 ] [ 2.59741 2.72967 0.138309 ] [ 4.11134 4.10597 1.37335 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.604789850411302e-18 "source-value" -34.982347 } }