{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pmcn" } "basis-atom-coordinates" { "source-value" [ [ 0.25 0.128615 0.516465 ] [ 0.75 0.871385 0.483535 ] [ 0.75 0.628615 0.983535 ] [ 0.25 0.371385 0.016465 ] [ 0.25 0.428007 0.562275 ] [ 0.75 0.571993 0.437725 ] [ 0.75 0.928007 0.937725 ] [ 0.25 0.071993 0.062275 ] [ 0.25 0.809737 0.080714 ] [ 0.75 0.190263 0.919286 ] [ 0.75 0.309737 0.419286 ] [ 0.25 0.690263 0.580714 ] [ 0.25 0.237268 0.255899 ] [ 0.75 0.762732 0.744101 ] [ 0.75 0.737268 0.244101 ] [ 0.25 0.262732 0.755899 ] [ 0.25 0.940629 0.28724 ] [ 0.75 0.059371 0.71276 ] [ 0.75 0.440629 0.21276 ] [ 0.25 0.559371 0.78724 ] [ 0.25 0.584345 0.294 ] [ 0.75 0.415655 0.706 ] [ 0.75 0.084345 0.206 ] [ 0.25 0.915655 0.794 ] [ 0.25 0.591377 0.139656 ] [ 0.75 0.408623 0.860344 ] [ 0.75 0.091377 0.360344 ] [ 0.25 0.908623 0.639656 ] [ 0.25 0.424173 0.365808 ] [ 0.75 0.575827 0.634192 ] [ 0.75 0.924173 0.134192 ] [ 0.25 0.075827 0.865808 ] [ 0.25 0.732153 0.382749 ] [ 0.75 0.267847 0.617251 ] [ 0.75 0.232153 0.117251 ] [ 0.25 0.767847 0.882749 ] ] } "species" { "source-value" [ "K" "K" "K" "K" "Na" "Na" "Na" "Na" "Na" "Na" "Na" "Na" "Na" "Na" "Na" "Na" "Na" "Na" "Na" "Na" "Ge" "Ge" "Ge" "Ge" "As" "As" "As" "As" "As" "As" "As" "As" "As" "As" "As" "As" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 4.82358851 "source-unit" "angstrom" } "b" { "source-value" 13.24266842 "source-unit" "angstrom" } "c" { "source-value" 15.29391564 "source-unit" "angstrom" } }