{ "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" [ 5.49393 0 0 ] "si-unit" "m" "si-value" [ 5.49393e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.002595 5.45604 0 ] "si-unit" "m" "si-value" [ 2.595e-13 5.45604e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0698117 0.0748179 5.57684 ] "si-unit" "m" "si-value" [ -6.981170000000001e-12 7.48179e-12 5.57684e-10 ] } "unrelaxed-configuration-positions" { "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 ] ] "source-unit" "angstrom" "si-unit" "m" "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 ] ] } "unrelaxed-configuration-forces" { "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 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.586817367698159e-09 -9.053469173219453e-10 -3.748136343456511e-09 ] [ -5.652596924734599e-09 -1.249578252143104e-09 4.81402808864712e-09 ] [ 1.846650042881782e-09 1.0769275378456e-09 -4.123930237532143e-09 ] [ -4.282805597348178e-09 4.864187592745421e-09 -2.132855346549362e-09 ] [ 6.691831975524042e-10 -1.728268095313463e-09 3.417439716186395e-09 ] [ -2.005212497601197e-09 -9.289803044147524e-10 4.309732258512171e-09 ] [ 7.828916279228775e-09 2.795546684598462e-10 -3.747160457668741e-09 ] [ 9.048292540515e-12 -1.408496229857603e-09 1.210882321861072e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.982347 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.604789896587999e-18 } }