TY  - BOOK
AU  - Foresman,James B.
AU  - Frisch,Aeleen
TI  - Exploring chemistry with electronic structure methods
SN  - 978-1-935522-03-4
PY  - 2015///
CY  - Wallingford
PB  - Gaussian
KW  - Ingeniería química
KW  - Estructura electrónica
KW  - Materiales
KW  - Propiedades eléctricas
N1  - Índice; Bibliografía: p. 503-522
N2  - This book will teach you how to use electronic structure calculations to investigate chemical problems. It uses the Gaussian software package as its tool for exploring molecular systems and chemical reactions. Is also discusses preparing input files and visualizing results using the GaussView and WebMo graphical user interfaces. Exploring Chemistry will be helpful to most Gaussian users, from beginners just stating to use calculations to experienced users who want to become familiar with advanced modeling techniques and capabilities
ER  -