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Quantum Crystallography (Hardcover): Chérif Matta, Lulu Huang, Louis Massa Quantum Crystallography (Hardcover)
Chérif Matta, Lulu Huang, Louis Massa
R3,707 Discovery Miles 37 070
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Quantum Crystallography is a novel scientific discipline combining quantum chemistry methods and crystal structure determination. The current book describes 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 DFT, Clinton equations, KEM and QTAIM methods and their applications in crystallographic studies.

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