Exploring chemistry with electronic structure methods / James B. Foresman, Aeleen Frisch
Tipo de material:
TextoDetalles de publicación: Wallingford : Gaussian, 2015 Edición: 3rd ed.Descripción: XV, 531 p. : il. ; 24 cmISBN: 978-1-935522-03-4Tema(s): Ingeniería química | Estructura electrónica | Materiales -- Propiedades eléctricasResumen: 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.
| Tipo de ítem | Biblioteca de origen | Signatura | Estado | Fecha de vencimiento | Código de barras | Reserva de ítems | Bibliografía recomendada |
|---|---|---|---|---|---|---|---|
| Monografías | 02. BIBLIOTECA CAMPUS PUERTO REAL | 54:681.3/FOR/exp (Navegar estantería(Abre debajo)) | Prestado | 31/01/2020 | 3744043699 | ||
| Manuales | 02. BIBLIOTECA CAMPUS PUERTO REAL | 54:681.3/FOR/exp (Navegar estantería(Abre debajo)) | Disponible Ubicación en estantería | Bibliomaps® | 374404368X | |||
| Manuales | 02. BIBLIOTECA CAMPUS PUERTO REAL | 54:681.3/FOR/exp (Navegar estantería(Abre debajo)) | Disponible Ubicación en estantería | Bibliomaps® | 3744043670 | |||
| Manuales | 02. BIBLIOTECA CAMPUS PUERTO REAL | 54:681.3/FOR/exp (Navegar estantería(Abre debajo)) | Disponible Ubicación en estantería | Bibliomaps® | 3744043661 |
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Bibliografía: p. 503-522
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.
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