Utilizing super-atom orbital ideas to understand properties of silver clusters inside ZSM-5 zeolite-Reference-Cited by-同舟云学术

Utilizing super-atom orbital ideas to understand properties of silver clusters inside ZSM-5 zeolite

Published:2017 Issue:9 Volume:7 Page:4950-4959
ISSN:2046-2069
Container-title:RSC Advances
language:en
Short-container-title:RSC Adv.

Author:

Yumura Takashi¹²³⁴^ORCID,Kumondai Mitsuhiro¹²³⁴,Kuroda Yasushige⁵⁶⁷⁸⁴,Wakasugi Takashi¹²³⁴,Kobayashi Hisayoshi¹²³⁴

Affiliation:

1. Department of Chemistry and Materials Technology

2. Kyoto Institute of Technology

3. Kyoto

4. Japan

5. Department of Chemistry

6. Graduate School of Natural Science and Technology

7. Okayama University

8. Okayama 700-8530

Abstract

The energetic properties of Agn clusters in ZSM-5 zeolite, obtained from density functional theory (DFT) calculations with the B3PW91 functional, can be well understood by utilizing super-atom orbital ideas.

Funder

Japan Society for the Promotion of Science

Publisher

Royal Society of Chemistry (RSC)

Subject

General Chemical Engineering,General Chemistry

Link

http://pubs.rsc.org/en/content/articlepdf/2017/RA/C6RA26492A

Reference79 articles.

1. Electronic Shell Structure and Abundances of Sodium Clusters

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