Systematic Investigation of the Structure, Stability, and Spin Magnetic Moment of CrMn Clusters (M = Cu, Ag, Au, and n = 2–20) by DFT Calculations

Author:

Mai Nguyen Thi1,Lan Ngo Thi12,Cuong Ngo Tuan3,Tam Nguyen Minh45,Ngo Son Tung56ORCID,Phung Thu Thi7,Dang Nguyen Van2,Tung Nguyen Thanh1ORCID

Affiliation:

1. Institute of Materials Science and Graduate University of Science and Technology, Vietnam Academy of Science and Technology, Hanoi 11307, Vietnam

2. Department of Physics and Technology, Thai Nguyen University of Science, Thai Nguyen 250000, Vietnam

3. Center for Computational Science, Hanoi National University of Education, Hanoi 11310, Vietnam

4. Computational Chemistry Research Group, Ton Duc Thang University, Ho Chi Minh City 72915, Vietnam

5. Faculty of Applied Sciences, Ton Duc Thang University, Ho Chi Minh City 72915, Vietnam

6. Laboratory of Theoretical and Computational Biophysics, Ton Duc Thang University, Ho Chi Minh City 72915, Vietnam

7. University of Science and Technology of Hanoi, Vietnam Academy of Science and Technology, Hanoi 11307, Vietnam

Funder

B??? Gi??o d???c v?? ????o t???o

Institute of Materials Science, Vietnam Academy of Science and Technology

Publisher

American Chemical Society (ACS)

Subject

General Chemical Engineering,General Chemistry

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