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Angewandte Chemie - International Edition

Volumn 52, Issue 26, 2013, Pages 6629-6632

Many-body dispersion interactions in molecular crystal polymorphism

(8) Marom, Noa a Distasio, Robert A b Atalla, Viktor c Levchenko, Sergey c Reilly, Anthony M c Chelikowsky, James R a Leiserowitz, Leslie d Tkatchenko, Alexandre c

a UNIVERSITY OF TEXAS AT AUSTIN (United States)

b PRINCETON UNIVERSITY (United States)

c FRITZ HABER INSTITUT DER MAX PLANCK GESELLSCHAFT (Germany)

d WEIZMANN INSTITUTE OF SCIENCE (Israel)

Author keywords

ab initio calculations; dispersion interactions; intermolecular interactions; molecular crystals; polymorphism

Indexed keywords

AMINO ACIDS; CALCULATIONS; DENSITY FUNCTIONAL THEORY; DISPERSIONS; POTENTIAL ENERGY; QUANTUM CHEMISTRY;

AB INITIO CALCULATIONS; CRYSTAL POLYMORPHISM; DENSITY FUNCTIONALS; DISPERSION CORRECTION; DISPERSION INTERACTION; INTERMOLECULAR INTERACTIONS; MANY BODY; POTENTIAL-ENERGY SURFACES; RELATIVE ENERGIES; Γ-GLYCINE;

MOLECULAR CRYSTALS;

EID: 84879363379 PISSN: 14337851 EISSN: 15213773 Source Type: Journal
DOI: 10.1002/anie.201301938 Document Type: Article

Times cited : (172)

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