메뉴 건너뛰기




Volumn 103, Issue 26, 2009, Pages

Multiferroicity in TTF-CA organic molecular crystals predicted through Ab initio calculations

Author keywords

[No Author keywords available]

Indexed keywords

AB INITIO CALCULATIONS; ANTIFERROMAGNETIC ORDERINGS; ELECTRONIC CONTRIBUTIONS; ELECTRONIC INTERACTIONS; EXTENDED HUBBARD MODEL; IONIC STATE; MAGNETIC ORDERING; MULTIFERROICS; ORGANIC MOLECULAR CRYSTAL; PEIERLS TRANSITION;

EID: 73649119227     PISSN: 00319007     EISSN: 10797114     Source Type: Journal    
DOI: 10.1103/PhysRevLett.103.266401     Document Type: Article
Times cited : (97)

References (51)
  • 1
    • 22244439844 scopus 로고    scopus 로고
    • SCIEAS 0036-8075 10.1126/science.1113357
    • N.A. Spaldin and M. Fiebig, Science 309, 391 (2005). SCIEAS 0036-8075 10.1126/science.1113357
    • (2005) Science , vol.309 , pp. 391
    • Spaldin, N.A.1    Fiebig, M.2
  • 2
    • 33747623307 scopus 로고    scopus 로고
    • NATUAS 0028-0836 10.1038/nature05023
    • W. Eerenstein, Nature (London) 442, 759 (2006). NATUAS 0028-0836 10.1038/nature05023
    • (2006) Nature (London) , vol.442 , pp. 759
    • Eerenstein, W.1
  • 3
    • 33846006567 scopus 로고    scopus 로고
    • NMAACR 1476-1122 10.1038/nmat1804
    • S.-W Cheong and M. Mostovoy, Nature Mater. 6, 13 (2007). NMAACR 1476-1122 10.1038/nmat1804
    • (2007) Nature Mater. , vol.6 , pp. 13
    • Cheong, S.-W.1    Mostovoy, M.2
  • 4
    • 36448970146 scopus 로고    scopus 로고
    • PRLTAO 0031-9007 10.1103/PhysRevLett.99.227201
    • S. Picozzi, Phys. Rev. Lett. 99, 227201 (2007). PRLTAO 0031-9007 10.1103/PhysRevLett.99.227201
    • (2007) Phys. Rev. Lett. , vol.99 , pp. 227201
    • Picozzi, S.1
  • 5
    • 42549101247 scopus 로고    scopus 로고
    • NMAACR 1476-1122 10.1038/nmat2137
    • S. Horiuchi, Nature Mater. 7, 357 (2008). NMAACR 1476-1122 10.1038/nmat2137
    • (2008) Nature Mater. , vol.7 , pp. 357
    • Horiuchi, S.1
  • 6
    • 33744602934 scopus 로고
    • PRLTAO 0031-9007 10.1103/PhysRevLett.47.1747
    • J.B. Torrance, Phys. Rev. Lett. 47, 1747 (1981). PRLTAO 0031-9007 10.1103/PhysRevLett.47.1747
    • (1981) Phys. Rev. Lett. , vol.47 , pp. 1747
    • Torrance, J.B.1
  • 7
    • 0000144619 scopus 로고    scopus 로고
    • PRLTAO 0031-9007 10.1103/PhysRevLett.79.1690
    • M.H. Lemme-Cailleau, Phys. Rev. Lett. 79, 1690 (1997). PRLTAO 0031-9007 10.1103/PhysRevLett.79.1690
    • (1997) Phys. Rev. Lett. , vol.79 , pp. 1690
    • Lemme-Cailleau, M.H.1
  • 8
    • 4244195760 scopus 로고
    • PRBMDO 0163-1829 10.1103/PhysRevB.51.3374
    • M. Le Cointe, Phys. Rev. B PRBMDO 0163-1829 51, 3374 (1995). 10.1103/PhysRevB.51.3374
    • (1995) Phys. Rev. B , vol.51 , pp. 3374
    • Le Cointe, M.1
  • 9
    • 0000604302 scopus 로고
    • PRBMDO 0163-1829 10.1103/PhysRevB.43.8224
    • S. Okamoto, Phys. Rev. B PRBMDO 0163-1829 43, 8224 (1991). 10.1103/PhysRevB.43.8224
    • (1991) Phys. Rev. B , vol.43 , pp. 8224
    • Okamoto, S.1
  • 10
    • 2342615628 scopus 로고    scopus 로고
    • JCPSA6 0021-9606 10.1063/1.1665824
    • Z.G. Soos, J. Chem. Phys. 120, 6712 (2004). JCPSA6 0021-9606 10.1063/1.1665824
    • (2004) J. Chem. Phys. , vol.120 , pp. 6712
    • Soos, Z.G.1
  • 11
    • 0002396028 scopus 로고
    • MCLCA5 0026-8941 10.1080/00268948508080088
    • Y. Tokura, Mol. Cryst. Liq. Cryst. 125, 71 (1985). MCLCA5 0026-8941 10.1080/00268948508080088
    • (1985) Mol. Cryst. Liq. Cryst. , vol.125 , pp. 71
    • Tokura, Y.1
  • 12
    • 0000659338 scopus 로고
    • JCPSA6 0021-9606 10.1063/1.445833
    • A. Girlando, J. Chem. Phys. 79, 1075 (1983). JCPSA6 0021-9606 10.1063/1.445833
    • (1983) J. Chem. Phys. , vol.79 , pp. 1075
    • Girlando, A.1
  • 13
    • 10644250257 scopus 로고
    • PHRVAO 0031-899X 10.1103/PhysRev.136.B864
    • P. Hohenberg, Phys. Rev. 136, B864 (1964). PHRVAO 0031-899X 10.1103/PhysRev.136.B864
    • (1964) Phys. Rev. , vol.136 , pp. 864
    • Hohenberg, P.1
  • 14
    • 4243943295 scopus 로고    scopus 로고
    • PRLTAO 0031-9007 10.1103/PhysRevLett.77.3865
    • J.P. Perdew, Phys. Rev. Lett. 77, 3865 (1996). PRLTAO 0031-9007 10.1103/PhysRevLett.77.3865
    • (1996) Phys. Rev. Lett. , vol.77 , pp. 3865
    • Perdew, J.P.1
  • 15
    • 25044437775 scopus 로고
    • PRBMDO 0163-1829 10.1103/PhysRevB.49.16223
    • P.E. Blöchl, Phys. Rev. B PRBMDO 0163-1829 49, 16223 (1994). 10.1103/PhysRevB.49.16223
    • (1994) Phys. Rev. B , vol.49 , pp. 16223
    • Blöchl, P.E.1
  • 16
    • 2442537377 scopus 로고    scopus 로고
    • PRBMDO 0163-1829 10.1103/PhysRevB.54.11169
    • G. Kresse, Phys. Rev. B PRBMDO 0163-1829 54, 11169 (1996); 10.1103/PhysRevB.54.11169
    • (1996) Phys. Rev. B , vol.54 , pp. 11169
    • Kresse, G.1
  • 17
    • 0030190741 scopus 로고    scopus 로고
    • CMMSEM 0927-0256 10.1016/0927-0256(96)00008-0
    • G. Kresse, Comput. Mater. Sci. 6, 15 (1996). CMMSEM 0927-0256 10.1016/0927-0256(96)00008-0
    • (1996) Comput. Mater. Sci. , vol.6 , pp. 15
    • Kresse, G.1
  • 18
    • 3543103556 scopus 로고
    • PRBMDO 0163-1829 10.1103/PhysRevB.47.1651
    • R.D. King-Smith, Phys. Rev. B PRBMDO 0163-1829 47, 1651 (1993); 10.1103/PhysRevB.47.1651
    • (1993) Phys. Rev. B , vol.47 , pp. 1651
    • King-Smith, R.D.1
  • 19
    • 33747073706 scopus 로고
    • PRBMDO 0163-1829 10.1103/PhysRevB.48.4442
    • D. Vanderbilt, Phys. Rev. B PRBMDO 0163-1829 48, 4442 (1993). 10.1103/PhysRevB.48.4442
    • (1993) Phys. Rev. B , vol.48 , pp. 4442
    • Vanderbilt, D.1
  • 20
    • 0031146149 scopus 로고    scopus 로고
    • SSCOA4 0038-1098 10.1016/S0038-1098(97)00030-6
    • Katan, Solid State Commun. SSCOA4 0038-1098 102, 589 (1997). 10.1016/S0038-1098(97)00030-6
    • (1997) Solid State Commun. , vol.102 , pp. 589
    • Katan1
  • 21
    • 0037438264 scopus 로고    scopus 로고
    • PRBMDO 0163-1829 10.1103/PhysRevB.67.035120
    • Oison, Phys. Rev. B PRBMDO 0163-1829 67, 035120 (2003). 10.1103/PhysRevB.67.035120
    • (2003) Phys. Rev. B , vol.67 , pp. 035120
    • Oison1
  • 22
    • 24844464541 scopus 로고
    • PRLTAO 0031-9007 10.1103/PhysRevLett.47.1840
    • F.D.M. Haldane, Phys. Rev. Lett. 47, 1840 (1981). PRLTAO 0031-9007 10.1103/PhysRevLett.47.1840
    • (1981) Phys. Rev. Lett. , vol.47 , pp. 1840
    • Haldane, F.D.M.1
  • 23
    • 38049123534 scopus 로고    scopus 로고
    • RMPHAT 0034-6861 10.1103/RevModPhys.80.3
    • S. Kümmel and L. Kronik, Rev. Mod. Phys. 80, 3 (2008). RMPHAT 0034-6861 10.1103/RevModPhys.80.3
    • (2008) Rev. Mod. Phys. , vol.80 , pp. 3
    • Kümmel, S.1    Kronik, L.2
  • 25
    • 0037449440 scopus 로고    scopus 로고
    • CHPLBC 0009-2614 10.1016/S0009-2614(02)01879-1
    • W.F. Perger, Chem. Phys. Lett. 368, 319 (2003). CHPLBC 0009-2614 10.1016/S0009-2614(02)01879-1
    • (2003) Chem. Phys. Lett. , vol.368 , pp. 319
    • Perger, W.F.1
  • 26
    • 35949006498 scopus 로고
    • PRBMDO 0163-1829 10.1103/PhysRevB.52.R5467
    • A.I. Liechtenstein, Phys. Rev. B PRBMDO 0163-1829 52, R5467 (1995). 10.1103/PhysRevB.52.R5467
    • (1995) Phys. Rev. B , vol.52 , pp. 5467
    • Liechtenstein, A.I.1
  • 27
    • 0037799714 scopus 로고    scopus 로고
    • JCPSA6 0021-9606 10.1063/1.1564060
    • J. Heyd, J. Chem. Phys. 118, 8207 (2003); JCPSA6 0021-9606 10.1063/1.1564060
    • (2003) J. Chem. Phys. , vol.118 , pp. 8207
    • Heyd, J.1
  • 28
    • 34547139312 scopus 로고    scopus 로고
    • JCPSA6 0021-9606 10.1063/1.2204597
    • J. Heyd, J. Chem. Phys. 124, 219906 (2006). JCPSA6 0021-9606 10.1063/1.2204597
    • (2006) J. Chem. Phys. , vol.124 , pp. 219906
    • Heyd, J.1
  • 29
    • 23344454109 scopus 로고    scopus 로고
    • JCPSA6 0021-9606 10.1063/1.1926272
    • J. Paier, J. Chem. Phys. 122, 234102 (2005). JCPSA6 0021-9606 10.1063/1.1926272
    • (2005) J. Chem. Phys. , vol.122 , pp. 234102
    • Paier, J.1
  • 30
    • 43049085214 scopus 로고    scopus 로고
    • JCOMEL 0953-8984 10.1088/0953-8984/20/6/064201
    • M. Marsman, J. Phys. Condens. Matter JCOMEL 0953-8984 20, 064201 (2008). 10.1088/0953-8984/20/6/064201
    • (2008) J. Phys. Condens. Matter , vol.20 , pp. 064201
    • Marsman, M.1
  • 31
    • 84893169025 scopus 로고
    • JCCHDD 0192-8651 10.1002/jcc.540141112
    • M.W. Schmidt, J. Comput. Chem. 14, 1347 (1993). JCCHDD 0192-8651 10.1002/jcc.540141112
    • (1993) J. Comput. Chem. , vol.14 , pp. 1347
    • Schmidt, M.W.1
  • 32
    • 19644401145 scopus 로고    scopus 로고
    • PRLTAO 0031-9007 10.1103/PhysRevLett.93.167602
    • S. Onoda, Phys. Rev. Lett. 93, 167602 (2004). PRLTAO 0031-9007 10.1103/PhysRevLett.93.167602
    • (2004) Phys. Rev. Lett. , vol.93 , pp. 167602
    • Onoda, S.1
  • 33
    • 44949212750 scopus 로고    scopus 로고
    • PRLTAO 0031-9007 10.1103/PhysRevLett.100.227603
    • G. Giovannetti and J. van den Brink, Phys. Rev. Lett. 100, 227603 (2008). PRLTAO 0031-9007 10.1103/PhysRevLett.100.227603
    • (2008) Phys. Rev. Lett. , vol.100 , pp. 227603
    • Giovannetti, G.1    Van Den Brink, J.2
  • 34
    • 0004395881 scopus 로고
    • JUPSAU 0031-9015 10.1143/JPSJ.55.2735
    • N. Nagaosa and J. Takimoto, J. Phys. Soc. Jpn. JUPSAU 0031-9015 55, 2735 (1986). 10.1143/JPSJ.55.2735
    • (1986) J. Phys. Soc. Jpn. , vol.55 , pp. 2735
    • Nagaosa, N.1    Takimoto, J.2
  • 35
    • 34547999264 scopus 로고    scopus 로고
    • PRLTAO 0031-9007 10.1103/PhysRevLett.89.027402
    • L. Del Freo, Phys. Rev. Lett. 89, 027402 (2002). PRLTAO 0031-9007 10.1103/PhysRevLett.89.027402
    • (2002) Phys. Rev. Lett. , vol.89 , pp. 027402
    • Del Freo, L.1
  • 36
    • 1442288322 scopus 로고    scopus 로고
    • PRBMDO 0163-1829 10.1103/PhysRevB.69.035103
    • M. Tsuchiizu and A. Furusaki, Phys. Rev. B PRBMDO 0163-1829 69, 035103 (2004). 10.1103/PhysRevB.69.035103
    • (2004) Phys. Rev. B , vol.69 , pp. 035103
    • Tsuchiizu, M.1    Furusaki, A.2
  • 37
    • 0001377101 scopus 로고
    • PRBMDO 0163-1829 10.1103/PhysRevB.37.5748
    • A. Painelli and A. Girlando, Phys. Rev. B PRBMDO 0163-1829 37, 5748 (1988). 10.1103/PhysRevB.37.5748
    • (1988) Phys. Rev. B , vol.37 , pp. 5748
    • Painelli, A.1    Girlando, A.2
  • 38
    • 73649120840 scopus 로고    scopus 로고
    • PRBMDO 0163-1829 (to be published);
    • M.F. Craciun, Phys. Rev. B PRBMDO 0163-1829 (to be published);
    • Phys. Rev. B
    • Craciun, M.F.1
  • 39
    • 38849087240 scopus 로고    scopus 로고
    • PRBMDO 0163-1829 10.1103/PhysRevB.77.035133
    • G. Giovannetti, Phys. Rev. B PRBMDO 0163-1829 77, 035133 (2008). 10.1103/PhysRevB.77.035133
    • (2008) Phys. Rev. B , vol.77 , pp. 035133
    • Giovannetti, G.1
  • 40
    • 19644376740 scopus 로고    scopus 로고
    • PRLTAO 0031-9007 10.1103/PhysRevLett.93.117002
    • E. Tosatti, Phys. Rev. Lett. 93, 117002 (2004). PRLTAO 0031-9007 10.1103/PhysRevLett.93.117002
    • (2004) Phys. Rev. Lett. , vol.93 , pp. 117002
    • Tosatti, E.1
  • 41
    • 0037189319 scopus 로고    scopus 로고
    • SCIEAS 0036-8075 10.1126/science.1071122
    • M. Capone, Science 296, 2364 (2002). SCIEAS 0036-8075 10.1126/science.1071122
    • (2002) Science , vol.296 , pp. 2364
    • Capone, M.1
  • 42
    • 19644401282 scopus 로고    scopus 로고
    • PRLTAO 0031-9007 10.1103/PhysRevLett.93.146405
    • G. Brocks, Phys. Rev. Lett. 93, 146405 (2004); PRLTAO 0031-9007 10.1103/PhysRevLett.93.146405
    • (2004) Phys. Rev. Lett. , vol.93 , pp. 146405
    • Brocks, G.1
  • 43
    • 0034636211 scopus 로고    scopus 로고
    • EULEEJ 0295-5075 10.1209/epl/i2000-00290-6
    • J. van den Brink, Europhys. Lett. 50, 447 (2000). EULEEJ 0295-5075 10.1209/epl/i2000-00290-6
    • (2000) Europhys. Lett. , vol.50 , pp. 447
    • Van Den Brink, J.1
  • 44
    • 34248141737 scopus 로고    scopus 로고
    • EPJBFY 1434-6028 10.1140/epjb/e2007-00110-y
    • L. Cano-Cortes, Eur. Phys. J. B EPJBFY 1434-6028 56, 173 (2007). 10.1140/epjb/e2007-00110-y
    • (2007) Eur. Phys. J. B , vol.56 , pp. 173
    • Cano-Cortes, L.1
  • 45
    • 0005129386 scopus 로고
    • PRBMDO 0163-1829 10.1103/PhysRevB.52.2484
    • M.B.J. Meinders, Phys. Rev. B PRBMDO 0163-1829 52, 2484 (1995); 10.1103/PhysRevB.52.2484
    • (1995) Phys. Rev. B , vol.52 , pp. 2484
    • Meinders, M.B.J.1
  • 46
    • 0031093425 scopus 로고    scopus 로고
    • EULEEJ 0295-5075 10.1209/epl/i1997-00174-3
    • J. van den Brink, Europhys. Lett. 37, 471 (1997). EULEEJ 0295-5075 10.1209/epl/i1997-00174-3
    • (1997) Europhys. Lett. , vol.37 , pp. 471
    • Van Den Brink, J.1
  • 47
    • 4243713169 scopus 로고
    • PRLTAO 0031-9007 10.1103/PhysRevLett.75.4658
    • J. van den Brink, Phys. Rev. Lett. 75, 4658 (1995); PRLTAO 0031-9007 10.1103/PhysRevLett.75.4658
    • (1995) Phys. Rev. Lett. , vol.75 , pp. 4658
    • Van Den Brink, J.1
  • 48
    • 0041136251 scopus 로고    scopus 로고
    • PRBMDO 0163-1829 10.1103/PhysRevB.54.R732
    • R. Eder, Phys. Rev. B PRBMDO 0163-1829 54, R732 (1996). 10.1103/PhysRevB.54.R732
    • (1996) Phys. Rev. B , vol.54 , pp. 732
    • Eder, R.1
  • 49
    • 0000262725 scopus 로고    scopus 로고
    • JCPSA6 0021-9606 10.1063/1.481133
    • D.M. Chipman, J. Chem. Phys. 112, 5558 (2000). JCPSA6 0021-9606 10.1063/1.481133
    • (2000) J. Chem. Phys. , vol.112 , pp. 5558
    • Chipman, D.M.1
  • 50
    • 37249050372 scopus 로고    scopus 로고
    • PRLTAO 0031-9007 10.1103/PhysRevLett.99.246403
    • M. Shishkin, Phys. Rev. Lett. 99, 246403 (2007). PRLTAO 0031-9007 10.1103/PhysRevLett.99.246403
    • (2007) Phys. Rev. Lett. , vol.99 , pp. 246403
    • Shishkin, M.1
  • 51
    • 34548736472 scopus 로고    scopus 로고
    • PRBMDO 0163-1829 10.1103/PhysRevB.76.115109
    • F. Fuchs, Phys. Rev. B PRBMDO 0163-1829 76, 115109 (2007). 10.1103/PhysRevB.76.115109
    • (2007) Phys. Rev. B , vol.76 , pp. 115109
    • Fuchs, F.1


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.