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Physica Status Solidi (B) Basic Research

Volumn 249, Issue 2, 2012, Pages 368-375

Hydrogen bond networks: Structure and dynamics via first-principles spectroscopy

(2) Schiffmann, Christoph a Sebastiani, Daniel a

a FREIE UNIVERSITÄT BERLIN (Germany)

Author keywords

First principles molecular dynamics simulations; Hydrogen bond networks; NMR spectroscopy

Indexed keywords

CALCULATIONS; FUNCTIONAL MATERIALS; ION EXCHANGE; MOLECULAR DYNAMICS; NUCLEAR MAGNETIC RESONANCE SPECTROSCOPY;

FIRST PRINCIPLES MOLECULAR DYNAMICS; FIRST-PRINCIPLES CALCULATION; HYDROGEN BOND NETWORKS; HYDROGEN BONDING NETWORK; MOLECULAR DYNAMICS SIMULATIONS; SPECTROSCOPIC PARAMETERS; STRUCTURE SPECTROSCOPY; SUPRAMOLECULAR ASSEMBLIES;

HYDROGEN BONDS;

EID: 84856054199 PISSN: 03701972 EISSN: 15213951 Source Type: Journal
DOI: 10.1002/pssb.201100556 Document Type: Review

Times cited : (12)

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