TY - BOOK AU - Foresman,James B. AU - Frisch,AEleen TI - Exploring chemistry with electronic structure methods SN - 9781935522034 AV - QD39.3.E46 F67 2015 F67 2015 U1 - 542/.85 23 PY - 2015/// CY - Wallingford, CT PB - Gaussian, Inc. KW - Chemistry KW - Data processing KW - Chemical models KW - fast N1 - Includes bibliographical references (pages 503-522) and index; Using Computations in Chemical Research -- Getting Started with Calculations -- Geometry Optimizations -- Predicting Chemical Properties -- Modeling Chemistry in Solution -- Studying Reaction Mechanisms -- Predicting Spectra -- Modeling Excited States -- Advanced Modeling Techniques -- The Theoretical Background -- Molecule index UR - http://expchem3.com/ ER -