A density functional theory computational study of the role of ligand on the stability of Cu i and Cu II species associated with ATRP and SET-LRP

Journal of Polymer Science, Part A: Polymer Chemistry

Volumn 45, Issue 21, 2007, Pages 4950-4964

  Rosen, Brad M ^a   Percec, Virgil ^a  

^a UNIVERSITY OF PENNSYLVANIA   (United States)

Author keywords

Atom transfer; ATRP; Calculations; Computer modeling; Conformational analysis; Living polymerization; Metal organic catalysts; Quantum chemistry; SET LRP; Single electron transfer

Indexed keywords

ATOM TRANSFERS; CONFORMATIONAL ANALYSIS; METAL ORGANIC CATALYSTS; SINGLE ELECTRON TRANSFER;

ATOM TRANSFER RADICAL POLYMERIZATION; CATALYST ACTIVITY; CONFORMATIONS; DENSITY FUNCTIONAL THEORY; LIGANDS; MATHEMATICAL MODELS; OXIDATION; QUANTUM CHEMISTRY;

COPPER COMPOUNDS;

EID: 35348962652     PISSN: 0887624X     EISSN: 10990518     Source Type: Journal    
DOI: 10.1002/pola.22328     Document Type: Article

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