{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-monoclinic-crystal-npt" "instance-id" 1 "space-group" { "source-value" "Pc" } "basis-atom-coordinates" { "source-value" [ [ 0.503283 0.244188 0.496632 ] [ 0.003283 0.755812 0.996632 ] [ 0.695691 0.879362 0.589919 ] [ 0.195691 0.120638 0.089919 ] [ 0.329127 0.95709 0.848669 ] [ 0.829127 0.04291 0.348669 ] [ 0.720573 0.600754 0.805187 ] [ 0.220573 0.399246 0.305187 ] [ 0.029385 0.783462 0.718271 ] [ 0.529385 0.216538 0.218271 ] [ 0.964943 0.680579 0.267273 ] [ 0.464943 0.319421 0.767273 ] [ 0.317642 0.486777 0.009912 ] [ 0.817642 0.513223 0.509912 ] [ 0.264268 0.585006 0.545416 ] [ 0.764268 0.414994 0.045416 ] [ 0.497891 0.214506 0.987189 ] [ 0.997891 0.785494 0.487189 ] [ 0.964189 0.267657 0.215937 ] [ 0.464189 0.732343 0.715937 ] [ 0.51683 0.498401 0.368021 ] [ 0.01683 0.501599 0.868021 ] [ 0.504578 0.977379 0.385502 ] [ 0.004578 0.022621 0.885502 ] [ 0.740428 0.245147 0.632642 ] [ 0.240428 0.754853 0.132642 ] [ 0.24617 0.242353 0.601432 ] [ 0.74617 0.757647 0.101432 ] ] } "species" { "source-value" [ "Nb" "Nb" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "Ag" "S" "S" "S" "S" "S" "S" "S" "S" "S" "S" "S" "S" ] } "cauchy-stress" { "source-value" [ 0 0 0 0 0 0 ] "source-unit" "GPa" } "temperature" { "source-value" 0 "source-unit" "K" } "a" { "source-value" 7.73605085937 "source-unit" "angstrom" } "b" { "source-value" 7.45306846 "source-unit" "angstrom" } "c" { "source-value" 10.9702510746 "source-unit" "angstrom" } "beta" { "source-value" 90.6307231205 "source-unit" "degree" } }