1 option
Quantum crystallography
- Format:
- Book
- Author/Creator:
- Matta, Chérif, Author.
- Huang, Lulu, Author.
- Massa, Louis, Author.
- Language:
- English
- Physical Description:
- 1 online resource (215 p.) ill
- Place of Publication:
- De Gruyter, c2023
- Summary:
- Quantum crystallography (QCr) is a novel scientific discipline combining quantum chemistry methods and crystal structure determination. Written by leading experts in the field, this book describes original quantum-mechanical approaches to obtain crystallographic data of enhanced value and explains how they correlate with real diffraction and scattering experiments. In particular, the book covers quantum N-representability, Clinton equations, kernel energy method (KEM), and quantum theory of atoms in molecules (QTAIM) methods and their applications in crystallographic studies. Readers will be interested in the Foreword written by Nobel Laureate Ada Yonath and the Epilogue by noted science philosopher Olimpia Lombardi.
- ISBN:
- 9783110566673
- 9783110565713
- 3110565714
The Penn Libraries is committed to describing library materials using current, accurate, and responsible language. If you discover outdated or inaccurate language, please fill out this feedback form to report it and suggest alternative language.