{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Cm" } "basis-atom-coordinates" { "source-value" [ [ 0.295861 0 0.430518 ] [ 0.031533 0.784545 0.065697 ] [ 0.138587 0 0.872725 ] [ 0.887817 0 0.182348 ] [ 0.740596 0 0.633951 ] [ 0.031533 0.215455 0.065697 ] [ 0.795861 0.5 0.430518 ] [ 0.531533 0.284545 0.065697 ] [ 0.638587 0.5 0.872725 ] [ 0.387817 0.5 0.182348 ] [ 0.240596 0.5 0.633951 ] [ 0.531533 0.715455 0.065697 ] [ 0.000523 0.749846 0.501023 ] [ 0.001439 0.5 0.00346 ] [ 0.500523 0.750154 0.501023 ] [ 0.500523 0.249846 0.501023 ] [ 0.501439 0 0.00346 ] [ 0.000523 0.250154 0.501023 ] [ 0.013788 0 0.027959 ] [ 0.513788 0.5 0.027959 ] ] } "species" { "source-value" [ "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Li" "Br" "Br" "Br" "Br" "Br" "Br" "N" "N" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 8.97156586 "source-unit" "angstrom" } "b" { "source-value" 8.93242678 "source-unit" "angstrom" } "c" { "source-value" 6.3893446 "source-unit" "angstrom" } "beta" { "source-value" 134.42084132 "source-unit" "degree" } }