Redox catalysis and reactivity of metalloporphyrines

High Performance Computing in Science and Engineering, Garching/Munich 2007 - Transactions of the 3rd Joint HLRB and KONWIHR Status and Result Workshop

Volumn , Issue , 2009, Pages 201-212

  Shubina, Tatyana E ^a   Clark, Timothy ^a  

^a UNIVERSITY OF ERLANGEN NUREMBERG   (Germany)

Author keywords

[No Author keywords available]

Indexed keywords

AG(111) SURFACE; DFT CALCULATION; ELECTRON-TRANSFER; GAS-PHASE REACTIONS; HYDROGEN TRANSFER; TEMPERATURE PROGRAMMED REACTIONS; TETRAPHENYL PORPHYRINS; TWO-STATE REACTIVITY;

ACTIVATION ENERGY; CATALYSIS; DENSITY FUNCTIONAL THEORY; NICKEL; PHASE INTERFACES; PHOTOELECTRONS; PORPHYRINS; QUANTUM CHEMISTRY; SCANNING TUNNELING MICROSCOPY; X RAY PHOTOELECTRON SPECTROSCOPY; ZINC;

CALCULATIONS;

EID: 84897677395     PISSN: None     EISSN: None     Source Type: Conference Proceeding    
DOI: None     Document Type: Conference Paper

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