{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-orthorhombic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pbn2_1" } "basis-atom-coordinates" { "source-value" [ [ 0.758775 0.003082 0.172274 ] [ 0.75893 0.253903 0.909272 ] [ 0.75893 0.246097 0.409272 ] [ 0.758775 0.496918 0.672274 ] [ 0.258775 0.503082 0.327726 ] [ 0.25893 0.753903 0.590728 ] [ 0.25893 0.746097 0.090728 ] [ 0.258775 0.996918 0.827726 ] [ 0.258752 0.244488 0.583194 ] [ 0.258752 0.255512 0.083194 ] [ 0.758752 0.744488 0.916806 ] [ 0.758752 0.755512 0.416806 ] [ 0.264039 0.003317 0.331953 ] [ 0.264039 0.496683 0.831953 ] [ 0.764039 0.503317 0.168047 ] [ 0.764039 0.996683 0.668047 ] [ 0.087109 0.991467 0.66924 ] [ 0.153473 0.999359 0.189889 ] [ 0.153964 0.281174 0.901515 ] [ 0.668083 0.212524 0.593952 ] [ 0.668083 0.287476 0.093952 ] [ 0.153964 0.218826 0.401515 ] [ 0.153473 0.500641 0.689889 ] [ 0.087109 0.508533 0.16924 ] [ 0.587109 0.491467 0.83076 ] [ 0.653473 0.499359 0.310111 ] [ 0.653964 0.781174 0.598485 ] [ 0.168083 0.712524 0.906048 ] [ 0.168083 0.787476 0.406048 ] [ 0.653964 0.718826 0.098485 ] [ 0.653473 0.000641 0.810111 ] [ 0.587109 0.008533 0.33076 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Mn" "Mn" "Mn" "Mn" "Si" "Si" "Si" "Si" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" "O" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 5.10748518 "source-unit" "angstrom" } "b" { "source-value" 6.34640223 "source-unit" "angstrom" } "c" { "source-value" 11.00089377 "source-unit" "angstrom" } }