{ "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" [ 5.33088 0 0 ] "si-unit" "m" "si-value" [ 5.33088e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0480326 5.46857 0 ] "si-unit" "m" "si-value" [ 4.80326e-12 5.46857e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.109209 0.182969 5.33745 ] "si-unit" "m" "si-value" [ -1.09209e-11 1.82969e-11 5.33745e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0970486 -0.0788825 -0.10937 ] [ 1.39157 1.38931 1.26283 ] [ -0.0444574 2.82173 2.6602 ] [ 1.24826 4.17435 3.90061 ] [ 2.67605 0.0682538 2.80056 ] [ 3.9766 1.50429 4.31462 ] [ 2.81042 2.80539 0.0255717 ] [ 4.1826 4.03217 1.44291 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -9.70486e-12 -7.88825e-12 -1.0937e-11 ] [ 1.39157e-10 1.38931e-10 1.26283e-10 ] [ -4.44574e-12 2.82173e-10 2.6602e-10 ] [ 1.24826e-10 4.17435e-10 3.90061e-10 ] [ 2.67605e-10 6.825380000000001e-12 2.80056e-10 ] [ 3.9766e-10 1.50429e-10 4.31462e-10 ] [ 2.81042e-10 2.80539e-10 2.55717e-12 ] [ 4.1826e-10 4.03217e-10 1.44291e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 4.6249955 -3.5111391 3.2832523 ] [ -0.6957298 -0.3053997 0.2806992 ] [ 2.7087768 -5.1007026 2.6489825 ] [ 0.4458767 0.5448087 1.175386 ] [ 0.8777232 0.5388512 -0.7332575 ] [ -2.6324774 2.9467067 -4.7973877 ] [ -1.5013779 0.7165616 0.7418535 ] [ -3.8277872 4.1703132 -2.5995283 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.410059661405206e-09 -5.625464978396753e-09 5.260350075247827e-09 ] [ -1.11468201995386e-09 -4.893042593393337e-10 4.497296957172633e-10 ] [ 4.339938859925438e-09 -8.172226455373774e-09 4.244137830408336e-09 ] [ 7.143732244994554e-10 8.72879761948441e-10 1.883175969615629e-09 ] [ 1.406267590573763e-09 8.633347947300249e-10 -1.174808023526256e-09 ] [ -4.21769374506437e-09 4.721144583094719e-09 -7.686262413853485e-09 ] [ -2.4054725703658e-09 1.148058242883041e-09 1.188580333758653e-09 ] [ -6.132791161237494e-09 6.681578310453635e-09 -4.164903467367968e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.818594 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.578553727592715e-18 } }