title: Revealing the true crystal structure of L-phenylalanine using solid-state density functional theory.
abstract: Solid-state density functional theory can be used for crystal structure determination from powder X-ray diffraction data of molecular crystals that are too large and complex for conventional refinement methods.
authors.affiliation: Department of Chemistry, Syracuse University, 1-014 Center for Science & Technology, 111 College Place, Syracuse, New York 13244-4100, USA.
authors.forename: Matthew D
authors.initials: MD
authors.lastname: King
authors.forename: Thomas N
authors.initials: TN
authors.lastname: Blanton
authors.forename: Timothy M
authors.initials: TM
authors.lastname: Korter
mesh_terms: D018360:Crystallography, X-Ray; D008958:Models, Molecular; D008968:Molecular Conformation; D010649:Phenylalanine / Q000737:chemistry*
chemical_list: D010649:Phenylalanine