NMR-based structural modeling of graphite oxide using multidimensional 13C solid-state NMR and ab initio chemical shift calculations

Journal of the American Chemical Society

Volumn 132, Issue 16, 2010, Pages 5672-5676

  Casabianca, Leah B ^a   Shaibat, Medhat A ^a   Cai, Weiwei W ^b   Park, Sungjin ^b   Piner, Richard ^b   Ruoff, Rodney S ^b   Ishii, Yoshitaka ^a  

^a UNIVERSITY OF ILLINOIS AT CHICAGO   (United States)

^b The University of Texas at Austin   (United States)

Author keywords

[No Author keywords available]

Indexed keywords

AB INITIO; AB INITIO CALCULATIONS; BENCHMARK SYSTEM; CHEMICAL SHIFT ANISOTROPY; CHEMICAL SHIFT TENSORS; CHEMICALLY MODIFIED; GEOMETRY OPTIMIZATION; GRAPHENES; GRAPHITE OXIDE; NANO-MATERIALS; OXIDIZED STRUCTURES; QUANTUM CORRELATIONS; SOLID STATE NMR; SPECTRAL FEATURE; SPECTROSCOPIC DATA; STRUCTURAL MODELING; STRUCTURAL MODELS;

COMPUTER SIMULATION; GRAPHENE; GRAPHITE; MODEL STRUCTURES; NUCLEAR MAGNETIC RESONANCE SPECTROSCOPY; OPTIMIZATION; SOLID STATE PHYSICS; SPACECRAFT;

CHEMICAL SHIFT;

CARBON; EPOXIDE; GRAPHENE; GRAPHITE; OXIDE;

ANISOTROPY; ARTICLE; CARBON NUCLEAR MAGNETIC RESONANCE; CHEMICAL STRUCTURE; CONTROLLED STUDY; GEOMETRY; OXIDATION; PROTON NUCLEAR MAGNETIC RESONANCE; SOLID STATE; CHEMISTRY; NUCLEAR MAGNETIC RESONANCE SPECTROSCOPY; QUANTUM THEORY;

GRAPHITE; MAGNETIC RESONANCE SPECTROSCOPY; QUANTUM THEORY;

EID: 77952556339     PISSN: 00027863     EISSN: 15205126     Source Type: Journal    
DOI: 10.1021/ja9030243     Document Type: Article

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