{ "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" [ 5.45804 0 0 ] "si-unit" "m" "si-value" [ 5.45804e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0357167 5.39587 0 ] "si-unit" "m" "si-value" [ -3.57167e-12 5.395870000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.019829 -0.0610013 5.23355 ] "si-unit" "m" "si-value" [ 1.9829e-12 -6.10013e-12 5.23355e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0872055 -0.452445 -0.0713075 ] [ 1.44372 1.30265 0.852604 ] [ 0.0844836 2.96191 2.59679 ] [ 1.14061 3.90928 3.87091 ] [ 2.7873 -0.319613 3.1468 ] [ 4.07117 1.23968 4.05459 ] [ 2.72619 2.52806 0.379157 ] [ 3.92833 3.98172 1.55502 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.720550000000001e-12 -4.52445e-11 -7.13075e-12 ] [ 1.44372e-10 1.30265e-10 8.526040000000001e-11 ] [ 8.44836e-12 2.96191e-10 2.59679e-10 ] [ 1.14061e-10 3.90928e-10 3.87091e-10 ] [ 2.7873e-10 -3.19613e-11 3.1468e-10 ] [ 4.071170000000001e-10 1.23968e-10 4.05459e-10 ] [ 2.72619e-10 2.52806e-10 3.79157e-11 ] [ 3.92833e-10 3.98172e-10 1.55502e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.024408 8.584596 9.3307498 ] [ -12.0769941 -12.69643 -0.5470756 ] [ -3.1303518 -4.4002505 -4.88571 ] [ 5.7515727 -0.1746125 1.3935452 ] [ 4.4890574 0.9336736 -1.923467 ] [ -3.2326591 1.6575723 2.338737 ] [ 10.3508202 5.5349436 -4.6473987 ] [ -2.1270374 0.5605076 -1.0593808 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.910592696048641e-11 1.37540390102132e-08 1.494950918409427e-08 ] [ -1.934947759655954e-08 -2.034192331362374e-08 -8.765117361301325e-10 ] [ -5.015376468839198e-09 -7.049978476763511e-09 -7.827770338008769e-09 ] [ 9.215035312771533e-09 -2.7976006519944e-10 2.23270553946806e-09 ] [ 7.192262815709234e-09 1.495910013378171e-09 -3.081733858280314e-09 ] [ -5.179290833036369e-09 2.655723586345684e-09 3.747069743599929e-09 ] [ 1.658384213054438e-08 8.867957233366587e-09 -7.445953544676313e-09 ] [ -3.407889593847218e-09 8.980321725007181e-10 -1.697315150284401e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.877711 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.383672073521899e-18 } }