First principles study of electric and magnetic properties of benzene-iron multiple-decked sandwich chain
We investigate electric and magnetic properties of a benzene-iron multiple-decked sandwich chain [Fe(C6H6)] ∞. By performing first principles calculation based on the density functional theory, we find that the system [Fe(C6H 6)]∞ is stable and has no magnetic moment for which the two succeeding iro...
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2006
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oai:animorepository.dlsu.edu.ph:faculty_research-48812021-07-26T01:36:24Z First principles study of electric and magnetic properties of benzene-iron multiple-decked sandwich chain Rahman, Md Mahmudur Muhida, Rifki Dy, Eben Sy Mozo, Romel Kasai, Hideaki We investigate electric and magnetic properties of a benzene-iron multiple-decked sandwich chain [Fe(C6H6)] ∞. By performing first principles calculation based on the density functional theory, we find that the system [Fe(C6H 6)]∞ is stable and has no magnetic moment for which the two succeeding iron atoms are antiferromagnetically arranged. We propose a superexchange interaction mechanism for this antiferromagnetic order. ©2006 The Physical Society of Japan. 2006-01-11T08:00:00Z text https://animorepository.dlsu.edu.ph/faculty_research/3968 info:doi/10.1143/JPSJ.75.114714 Faculty Research Work Animo Repository Antiferromagnetism Density functionals Physics |
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De La Salle University |
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Antiferromagnetism Density functionals Physics |
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Antiferromagnetism Density functionals Physics Rahman, Md Mahmudur Muhida, Rifki Dy, Eben Sy Mozo, Romel Kasai, Hideaki First principles study of electric and magnetic properties of benzene-iron multiple-decked sandwich chain |
| description |
We investigate electric and magnetic properties of a benzene-iron multiple-decked sandwich chain [Fe(C6H6)] ∞. By performing first principles calculation based on the density functional theory, we find that the system [Fe(C6H 6)]∞ is stable and has no magnetic moment for which the two succeeding iron atoms are antiferromagnetically arranged. We propose a superexchange interaction mechanism for this antiferromagnetic order. ©2006 The Physical Society of Japan. |
| format |
text |
| author |
Rahman, Md Mahmudur Muhida, Rifki Dy, Eben Sy Mozo, Romel Kasai, Hideaki |
| author_facet |
Rahman, Md Mahmudur Muhida, Rifki Dy, Eben Sy Mozo, Romel Kasai, Hideaki |
| author_sort |
Rahman, Md Mahmudur |
| title |
First principles study of electric and magnetic properties of benzene-iron multiple-decked sandwich chain |
| title_short |
First principles study of electric and magnetic properties of benzene-iron multiple-decked sandwich chain |
| title_full |
First principles study of electric and magnetic properties of benzene-iron multiple-decked sandwich chain |
| title_fullStr |
First principles study of electric and magnetic properties of benzene-iron multiple-decked sandwich chain |
| title_full_unstemmed |
First principles study of electric and magnetic properties of benzene-iron multiple-decked sandwich chain |
| title_sort |
first principles study of electric and magnetic properties of benzene-iron multiple-decked sandwich chain |
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Animo Repository |
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2006 |
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https://animorepository.dlsu.edu.ph/faculty_research/3968 |
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1767195999400361984 |