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Volumn 4, Issue 7, 2011, Pages 2417-2427

A nickel-manganese catalyst as a biomimic of the active site of NiFe hydrogenases: A combined electrocatalytical and DFT mechanistic study

Author keywords

[No Author keywords available]

Indexed keywords

ACTIVE SITE; ACTIVE STATE; BIO-INSPIRED; BRIDGING HYDRIDE; DINUCLEAR; HETEROLYTIC MECHANISMS; HYDROGEN EVOLUTION; HYDROGENASES; MECHANISTIC STUDIES; OVERPOTENTIAL; TRIFLUOROACETIC ACIDS;

EID: 79959814780     PISSN: 17545692     EISSN: 17545706     Source Type: Journal    
DOI: 10.1039/c0ee00736f     Document Type: Article
Times cited : (85)

References (61)
  • 25
    • 79959843184 scopus 로고    scopus 로고
    • This hypothesis is further supported by our DFT calculations of these related complexes (see below)
    • This hypothesis is further supported by our DFT calculations of these related complexes (see below)
  • 32
    • 79959817561 scopus 로고    scopus 로고
    • 3]Otf does not display any catalytic activity for TFA reduction in DMF at a glassy carbon electrode
    • 3]Otf does not display any catalytic activity for TFA reduction in DMF at a glassy carbon electrode
  • 33
    • 79959831704 scopus 로고    scopus 로고
    • DFT calculations also show that such a change in the isomeric form has no further effect regarding the catalytic cycle
    • DFT calculations also show that such a change in the isomeric form has no further effect regarding the catalytic cycle
  • 35
  • 42
    • 79959836594 scopus 로고    scopus 로고
    • We have chosen the first wave as the experimental determination of its amplitude is more accurate
    • We have chosen the first wave as the experimental determination of its amplitude is more accurate
  • 45
    • 79959825392 scopus 로고    scopus 로고
    • +/Fc, in which case simulations show that the catalytic process occurs on a third wave at lower potential
    • +/Fc, in which case simulations show that the catalytic process occurs on a third wave at lower potential
  • 55
    • 79959843708 scopus 로고    scopus 로고
    • -1 concentration of TFA in DMF
    • -1 concentration of TFA in DMF
  • 61
    • 79959823647 scopus 로고    scopus 로고
    • Schrödinger L.L.C., Portland, OR
    • Jaguar 5.2, Schrödinger L.L.C., Portland, OR, 2003
    • (2003) Jaguar 5.2


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.