{ "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" [ 5.37157 0 0 ] "si-unit" "m" "si-value" [ 5.37157e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.00742946 5.44743 0 ] "si-unit" "m" "si-value" [ -7.42946e-13 5.447429999999999e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0324182 0.1292 5.41398 ] "si-unit" "m" "si-value" [ 3.24182e-12 1.292e-11 5.41398e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0294164 -0.0853048 -0.0527531 ] [ 1.50657 1.46533 1.29324 ] [ 0.0376731 2.77305 2.66982 ] [ 1.30492 4.09759 4.08062 ] [ 2.57907 0.017247 2.67471 ] [ 4.14556 1.36588 4.04305 ] [ 2.78643 2.5664 0.0569683 ] [ 4.11497 4.06206 1.21769 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.94164e-12 -8.530480000000001e-12 -5.27531e-12 ] [ 1.50657e-10 1.46533e-10 1.29324e-10 ] [ 3.76731e-12 2.77305e-10 2.66982e-10 ] [ 1.30492e-10 4.09759e-10 4.08062e-10 ] [ 2.57907e-10 1.7247e-12 2.67471e-10 ] [ 4.14556e-10 1.36588e-10 4.04305e-10 ] [ 2.78643e-10 2.5664e-10 5.69683e-12 ] [ 4.114969999999999e-10 4.06206e-10 1.21769e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.2177756 1.2740802 0.5787402 ] [ -3.2003512 -1.8469881 0.9998881 ] [ 0.2962769 -0.5285175 -0.3021372 ] [ 1.4097449 -0.503627 -0.1616211 ] [ 2.4469146 -0.538737 0.2590427 ] [ -1.3397015 0.0920579 -0.8427404 ] [ 0.6203103 1.9962204 -2.5460149 ] [ -1.4509695 0.0555112 2.0148425 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.95109161177533e-09 2.041301526282046e-09 9.272440255964868e-10 ] [ -5.127527913233861e-09 -2.959201177096055e-09 1.601997350434655e-09 ] [ 4.746879263739545e-10 -8.467783891600949e-10 -4.840771621021847e-10 ] [ 2.258660338680666e-09 -8.068994116515179e-10 -2.589455499813774e-10 ] [ 3.920389397513456e-09 -8.631518332712579e-10 4.150321611482718e-10 ] [ -2.146438439834751e-09 1.474930163551086e-10 -1.350218977407813e-09 ] [ 9.9384666848953e-10 3.198297681194133e-09 -4.079165582595846e-09 ] [ -2.324709429546663e-09 8.893874756530079e-11 3.228133574690144e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.885653 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.7495154732432e-18 } }