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Volumn 22, Issue 1, 2002, Pages 29-49

Carbonates, thiocarbonates, and the corresponding monoalkyl derivatives: III. The 13C chemical shift tensors in potassium carbonate, bicarbonate and related monomethyl derivatives

(5) Stueber, Dirk a Orendt, Anita M a Facelli, Julio C a Parry, Robert W a Grant, David M a

a UNIVERSITY OF UTAH (United States)

Author keywords

13C; Calculations; Chemical shift tensors; Embedded ion method; Ewald; Madelung potential; Orientations; Principal values; Solid state; Summation method

Indexed keywords

AROMATIC HYDROCARBONS; CORRELATION METHODS; CRYSTALS; ELECTROSTATICS; NUCLEAR MAGNETIC RESONANCE; TENSORS; X RAYS;

CHEMICAL SHIFT TENSORS;

CARBONATES;

ANION; BICARBONATE; CARBON; CARBONIC ACID DERIVATIVE; POTASSIUM; POTASSIUM BICARBONATE; POTASSIUM CARBONATE; POTASSIUM DERIVATIVE;

ARTICLE; CHEMICAL MODEL; CHEMICAL STRUCTURE; CHEMISTRY; COMPARATIVE STUDY; COMPUTER SIMULATION; METHODOLOGY; NUCLEAR MAGNETIC RESONANCE SPECTROSCOPY;

ANIONS; BICARBONATES; CARBON ISOTOPES; CARBONATES; COMPUTER SIMULATION; MAGNETIC RESONANCE SPECTROSCOPY; MODELS, CHEMICAL; MODELS, MOLECULAR; MOLECULAR STRUCTURE; POTASSIUM; POTASSIUM COMPOUNDS;

EID: 0036667243 PISSN: 09262040 EISSN: None Source Type: Journal
DOI: 10.1006/snmr.2002.0061 Document Type: Article

Times cited : (35)

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