TY - RPRT TI - Testing the TPSS meta-generalized-gradient-approximation exchange-correlation functional in calculations of transition states and reaction barriers. AU - Yosuke Kanai AU - Xiaofei Wang AU - Annabella Selloni AU - Roberto Car PY - 2006 DO - 10.1063/1.2403861 UR - https://pubmed.ncbi.nlm.nih.gov/17190544/ ID - 17190544 ER -