2011 Fiscal Year Final Research Report
Mechanism of phase transitions in novel molecular conductors and transition metal oxides by constructing and analyzing effective models
| Project/Area Number |
21740270
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| Research Category |
Grant-in-Aid for Young Scientists (B)
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| Allocation Type | Single-year Grants |
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| Research Field |
Condensed matter physics II
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| Research Institution | The Institute of Physical and Chemical Research |
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Principal Investigator |
SEO Hitoshi 独立行政法人理化学研究所, 古崎物性理論研究室, 専任研究員 (30415054)
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| Project Period (FY) |
2009 – 2011
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| Keywords | 物性理論 / 分子性導体 / 遷移金属酸化物 / 相転移 / 磁性 / 金属絶縁体転移 / 電荷秩序 / 新規物質 |
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| Research Abstract |
In order to clarify the origin of novel phase transitions in molecular conductors and transition metal oxides, we have constructed effective models based on ab initio(first principles) band calculations. By considering electron correlation and electron-phonon interaction we succeeded in deriving microscopic models for several materials, and in proposing mechanism of unsolved problems of spin and charge ordering by model analyses.
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