Abstract
The path-integral renormalization group method is an efficient tool for computing electronic structure of strongly correlated electron systems. Combined with the conventional density functional approaches as a hybrid scheme, it offers a first-principles method for complex materials with involved electron correlation effects. We assess the efficiency and applicability of the hybrid scheme by examining applications to Sr2VO4 and YVO 3.
| Original language | English |
|---|---|
| Article number | 365230 |
| Journal | Journal of Physics Condensed Matter |
| Volume | 19 |
| Issue number | 36 |
| DOIs | |
| Publication status | Published - 2007 Sep 12 |
| Externally published | Yes |
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ASJC Scopus subject areas
- Materials Science(all)
- Condensed Matter Physics
Cite this
Applications of path-integral renormalization group method combined with density functional theory. / Imai, Yoshiki; Otsuka, Yuichi; Imada, Masatoshi.
In: Journal of Physics Condensed Matter, Vol. 19, No. 36, 365230, 12.09.2007.Research output: Contribution to journal › Article
}
TY - JOUR
T1 - Applications of path-integral renormalization group method combined with density functional theory
AU - Imai, Yoshiki
AU - Otsuka, Yuichi
AU - Imada, Masatoshi
PY - 2007/9/12
Y1 - 2007/9/12
N2 - The path-integral renormalization group method is an efficient tool for computing electronic structure of strongly correlated electron systems. Combined with the conventional density functional approaches as a hybrid scheme, it offers a first-principles method for complex materials with involved electron correlation effects. We assess the efficiency and applicability of the hybrid scheme by examining applications to Sr2VO4 and YVO 3.
AB - The path-integral renormalization group method is an efficient tool for computing electronic structure of strongly correlated electron systems. Combined with the conventional density functional approaches as a hybrid scheme, it offers a first-principles method for complex materials with involved electron correlation effects. We assess the efficiency and applicability of the hybrid scheme by examining applications to Sr2VO4 and YVO 3.
UR - http://www.scopus.com/inward/record.url?scp=34548792430&partnerID=8YFLogxK
UR - http://www.scopus.com/inward/citedby.url?scp=34548792430&partnerID=8YFLogxK
U2 - 10.1088/0953-8984/19/36/365230
DO - 10.1088/0953-8984/19/36/365230
M3 - Article
C2 - 21694175
AN - SCOPUS:34548792430
VL - 19
JO - Journal of Physics Condensed Matter
JF - Journal of Physics Condensed Matter
SN - 0953-8984
IS - 36
M1 - 365230
ER -