{ "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" [ 5.46497 0 0 ] "si-unit" "m" "si-value" [ 5.46497e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00264453 5.45437 0 ] "si-unit" "m" "si-value" [ 2.64453e-13 5.45437e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.00434361 0.134648 5.52148 ] "si-unit" "m" "si-value" [ -4.343610000000001e-13 1.34648e-11 5.521480000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.000601708 -0.00129581 -0.00103934 ] [ 1.36071 1.38338 1.29931 ] [ 0.0379757 2.81246 2.65752 ] [ 1.43056 4.2109 3.80234 ] [ 2.71672 0.059655 2.71923 ] [ 4.18219 1.40754 3.91392 ] [ 2.71688 2.7266 0.0375018 ] [ 4.08381 4.07468 1.29537 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.017079999999999e-14 -1.29581e-13 -1.03934e-13 ] [ 1.36071e-10 1.38338e-10 1.29931e-10 ] [ 3.79757e-12 2.812460000000001e-10 2.65752e-10 ] [ 1.43056e-10 4.2109e-10 3.80234e-10 ] [ 2.71672e-10 5.9655e-12 2.71923e-10 ] [ 4.18219e-10 1.40754e-10 3.91392e-10 ] [ 2.71688e-10 2.7266e-10 3.75018e-12 ] [ 4.08381e-10 4.07468e-10 1.29537e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.8050151 -0.847911 -2.3421546 ] [ -0.3202731 -0.1287622 0.9510537 ] [ 0.0130774 -0.5449498 -1.5338341 ] [ -1.8260391 -1.2800036 5.9062652 ] [ 2.1301773 1.176651 -3.4357401 ] [ -1.2033252 0.8502464 3.164977 ] [ 0.5747133 -0.306476 -3.7480266 ] [ -0.1733457 1.0812053 1.0374596 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.289776372610974e-09 -1.358503180719149e-09 -3.752545342419176e-09 ] [ -5.131340730911404e-10 -2.062997864827737e-10 1.523756003265337e-09 ] [ 2.095230454084992e-11 -8.731058290696359e-10 -2.457473135205809e-09 ] [ -2.925637154686674e-09 -2.050791842459835e-09 9.462880019684637e-09 ] [ 3.412920268218868e-09 1.885202723040941e-09 -5.504662463365054e-09 ] [ -1.927939502659484e-09 1.362244903999365e-09 5.070852154769722e-09 ] [ 9.207922129228166e-10 -4.910286820363008e-10 -6.005000592656514e-09 ] [ -2.777304278562105e-10 1.73228185394505e-09 1.66219351614452e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.456952 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.680829953922781e-18 } }