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Chemistry - A European Journal

Volumn 8, Issue 9, 2002, Pages 2099-2115

On the existence of CuI pairs in ZSM-5 - A computational study

(5) Spuhler, Philipp a Holthausen, Max C a Nachtigallová, Dana b Nachtigall, Petr b Sauer, Joachim c

a PHILIPPS UNIVERSITY MARBURG (Germany)

b J HEYROVSKÝ INSTITUTE OF PHYSICAL CHEMISTRY (Czech Republic)

c HUMBOLDT UNIVERSITY (Germany)

Author keywords

Copper; Density functional calculations; Ion pairs; QM Pot calculations; Zeolites

Indexed keywords

COMPUTATIONAL METHODS; CRYSTALS; POSITIVE IONS; ZEOLITES;

SINGLET-TRIPLET TRANSITIONS;

COPPER;

COPPER; ZEOLITE;

ARTICLE; CALCULATION; CHEMICAL ANALYSIS; CHEMICAL STRUCTURE; CRYSTAL; DENSITY; STRUCTURE ANALYSIS;

EID: 0037012761 PISSN: 09476539 EISSN: None Source Type: Journal
DOI: 10.1002/1521-3765(20020503)8:9<2099::AID-CHEM2099>3.0.CO;2-D Document Type: Article

Times cited : (32)

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