{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.37157e-10 0.0 0.0 ] "source-value" [ 5.37157 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -7.42946e-13 5.447429999999999e-10 0.0 ] "source-value" [ -0.00742946 5.44743 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 3.24182e-12 1.292e-11 5.41398e-10 ] "source-value" [ 0.0324182 0.1292 5.41398 ] } "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" [ [ 2.691875259835077e-09 2.52525529997836e-09 6.054442801868429e-10 ] [ -7.265199983759209e-09 -5.149992790477772e-09 3.039349237083022e-09 ] [ 1.12986264343594e-09 -5.337761962382035e-10 -6.620520641176243e-10 ] [ 2.351589287778689e-09 -8.731021440634081e-10 -4.041809359115539e-10 ] [ 5.958408335217677e-09 -6.709545585110995e-10 1.20611856013824e-11 ] [ -3.274386304307113e-09 -4.017994605823968e-10 -1.378049735492909e-09 ] [ 1.918892652152475e-09 5.035346318676172e-09 -5.936934682404419e-09 ] [ -3.511041890353536e-09 6.90233710006848e-11 4.724362715055258e-09 ] ] "source-value" [ [ 1.6801364 1.5761404 0.3778886 ] [ -4.5345812 -3.2143727 1.8970126 ] [ 0.7052048 -0.3331569 -0.4132204 ] [ 1.4677466 -0.5449475 -0.2522699 ] [ 3.718946 -0.4187769 0.007528 ] [ -2.0437112 -0.2507835 -0.860111 ] [ 1.1976786 3.142816 -3.7055432 ] [ -2.19142 0.043081 2.9487153 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "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 ] ] "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 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.309476335230122e-18 "source-value" -33.139145 } }