Splitting of multiple hydrogen molecules by bioinspired diniobium metal complexes: a DFT study-Reference-Cited by-同舟云学术

Splitting of multiple hydrogen molecules by bioinspired diniobium metal complexes: a DFT study

Author:

Fantuzzi Felipe¹²³⁴⁵^ORCID,Nascimento Marco Antonio Chaer¹²³⁴^ORCID,Ginovska Bojana⁵⁶⁷⁸^ORCID,Bullock R. Morris⁵⁶⁷⁸^ORCID,Raugei Simone⁵⁶⁷⁸^ORCID

Affiliation:

1. Instituto de Química

2. Universidade Federal do Rio de Janeiro

3. Rio de Janeiro

4. Brazil

5. Center for Molecular Electrocatalysis

6. Pacific Northwest National Laboratory

7. Richland

8. USA

Abstract

A novel organometallic platform for activation and splitting of multiple H₂ molecules is investigated by quantum chemical calculations.

Funder

Conselho Nacional de Desenvolvimento Científico e Tecnológico

Coordenação de Aperfeiçoamento de Pessoal de Nível Superior

U.S. Department of Energy

Fundação Carlos Chagas Filho de Amparo à Pesquisa do Estado do Rio de Janeiro

Alexander von Humboldt-Stiftung

Publisher

Royal Society of Chemistry (RSC)

Subject

Inorganic Chemistry

Link

Reference117 articles.

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