{ "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" [ [ -4.3523038 5.3881034 7.3015266 ] [ -11.3937173 -9.4212981 4.9363883 ] [ -3.7991278 -6.1852311 -5.5481023 ] [ 7.237685 -0.7373659 1.9113887 ] [ 2.2906185 0.5082878 -2.1844672 ] [ -0.234569 1.6726727 1.2396795 ] [ 10.3162736 7.6611631 -5.8772887 ] [ -0.0648591 1.1136681 -1.7791249 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.973159452429408e-09 8.632693369055956e-09 1.169833531104946e-08 ] [ -1.825474763246157e-08 -1.509458367776859e-08 7.908965990610981e-09 ] [ -6.086873790739824e-09 -9.909832744310117e-09 -8.889039868101658e-09 ] [ 1.159604979125229e-08 -1.181390415688381e-09 3.062382313631636e-09 ] [ 3.669975438108129e-09 8.143668365072651e-10 -3.499902305579405e-09 ] [ -3.75820970860746e-10 2.679917116269691e-09 1.986185528548803e-09 ] [ 1.652849251187106e-08 1.2274536508083e-08 -9.416454626412235e-09 ] [ -1.039157345222694e-10 1.784293007851175e-09 -2.850472343747586e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -20.547552 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.292080770029997e-18 } }