메뉴 건너뛰기




Volumn 3, Issue , 2014, Pages

Magnetic Exchange Coupling and Anisotropy of 3d Transition Metal Nanowires on Graphyne

Author keywords

[No Author keywords available]

Indexed keywords


EID: 84899829220     PISSN: None     EISSN: 20452322     Source Type: Journal    
DOI: 10.1038/srep04014     Document Type: Article
Times cited : (52)

References (61)
  • 1
    • 7444220645 scopus 로고    scopus 로고
    • Electric field effect in atomically thin carbon films
    • Novoselov, K. S. et al. Electric field effect in atomically thin carbon films. Science 306, 666-669 (2004).
    • (2004) Science , vol.306 , pp. 666-669
    • Novoselov, K.S.1
  • 2
    • 19944428003 scopus 로고    scopus 로고
    • Functionalized single graphene sheets derived from splitting graphite oxide
    • Berger, C. et al. Functionalized Single Graphene Sheets Derived from Splitting Graphite Oxide. J. Phys. Chem. B 108, 19912-19916 (2004).
    • (2004) J. Phys. Chem. B , vol.108 , pp. 19912-19916
    • Berger, C.1
  • 3
    • 33847367234 scopus 로고    scopus 로고
    • Graphene: Quantum information on chicken wire
    • Fal'Ko, V. Graphene: Quantum information on chicken wire. Nat. Phys. 3, 151-152 (2007).
    • (2007) Nat. Phys. , vol.3 , pp. 151-152
    • Fal'Ko, V.1
  • 4
    • 33751110207 scopus 로고    scopus 로고
    • Half-metallic graphene nanoribbons
    • Son, Y. W., Cohen, M. L. & Louie, S. G. Half-metallic graphene nanoribbons. Nature 444, 347-349 (2006).
    • (2006) Nature , vol.444 , pp. 347-349
    • Son, Y.W.1    Cohen, M.L.2    Louie, S.G.3
  • 5
    • 66249123595 scopus 로고    scopus 로고
    • N-doping of graphene through electrothermal reactions with ammonia
    • Wang, X. et al. N-doping of graphene through electrothermal reactions with ammonia. Science 324, 768-771 (2009).
    • (2009) Science , vol.324 , pp. 768-771
    • Wang, X.1
  • 6
    • 84861635548 scopus 로고    scopus 로고
    • Effective control of the charge and magnetic states of transition-metal atoms on single-layer boron nitride
    • Huang, B., Xiang, H., Yu, J. & Wei, S. H. Effective Control of the Charge and Magnetic States of Transition-Metal Atoms on Single-Layer Boron Nitride. Phys. Rev. Lett. 108, 206802 (2012).
    • (2012) Phys. Rev. Lett. , vol.108 , pp. 206802
    • Huang, B.1    Xiang, H.2    Yu, J.3    Wei, S.H.4
  • 7
    • 77957738464 scopus 로고    scopus 로고
    • Spin-transport selectivity upon Co adsorption on antiferromagnetic graphene nanoribbons
    • Cocchi, C., Prezzi, D., Calzolari, A. & Molinari, E. Spin-transport selectivity upon Co adsorption on antiferromagnetic graphene nanoribbons. J. Chem. Phy. 133, 124703(2010).
    • (2010) J. Chem. Phy. , vol.133 , pp. 124703
    • Cocchi, C.1    Prezzi, D.2    Calzolari, A.3    Molinari, E.4
  • 8
    • 79551617237 scopus 로고    scopus 로고
    • Gated adatoms ongraphene studied with first-principles calculations
    • Chan, K. T., Lee, H. & Cohen, M.L. Gated adatoms ongraphene studied with first-principles calculations. Phys. Rev. B 83, 035405 (2011).
    • (2011) Phys. Rev. B , vol.83 , pp. 035405
    • Chan, K.T.1    Lee, H.2    Cohen, M.L.3
  • 9
    • 84863328788 scopus 로고    scopus 로고
    • Clustering and magnetic anisotropy of Fe adatoms on graphene
    • Porter, C. D. & Stroud, D. Clustering and magnetic anisotropy of Fe adatoms on graphene. Phys. Rev. B 85, 235452 (2012)
    • (2012) Phys. Rev. B , vol.85 , pp. 235452
    • Porter, C.D.1    Stroud, D.2
  • 10
    • 67650088362 scopus 로고    scopus 로고
    • Density functional theory study of Fe, Co, and Ni adatoms and dimers adsorbed on graphene
    • Johll, H., Kang, H. C. & Tok, E. S. Density functional theory study of Fe, Co, and Ni adatoms and dimers adsorbed on graphene. Phys. Rev. B 79, 245416(2009).
    • (2009) Phys. Rev. B , vol.79 , pp. 245416
    • Johll, H.1    Kang, H.C.2    Tok, E.S.3
  • 11
    • 44349178651 scopus 로고    scopus 로고
    • Electronic and magnetic properties of 3d transition-metal atom adsorbed graphene and graphene nanoribbons
    • Sevincli, H., Topsakal, M., Durgun, E. & Ciraci, S. Electronic and magnetic properties of 3d transition-metal atom adsorbed graphene and graphene nanoribbons. Phys. Rev. B 77, 195434 (2008).
    • (2008) Phys. Rev. B , vol.77 , pp. 195434
    • Sevincli, H.1    Topsakal, M.2    Durgun, E.3    Ciraci, S.4
  • 12
    • 45749127809 scopus 로고    scopus 로고
    • First-principles study of metal adatom adsorption on graphene
    • Chan, K. T., Neaton, J. B. & Cohen, M. L. First-principles study of metal adatom adsorption on graphene. Phys. Rev. B 77, 235430(2008).
    • (2008) Phys. Rev. B , vol.77 , pp. 235430
    • Chan, K.T.1    Neaton, J.B.2    Cohen, M.L.3
  • 13
    • 77955759474 scopus 로고    scopus 로고
    • Transition metal adatom and dimer adsorbed on graphene: Induced magnetization and electronic structures
    • Cao, C., Wu, M., Jiang, J. & Cheng, H. P. Transition metal adatom and dimer adsorbed on graphene: Induced magnetization and electronic structures. Phys. Rev. B 81, 205424 (2011).
    • (2011) Phys. Rev. B , vol.81 , pp. 205424
    • Cao, C.1    Wu, M.2    Jiang, J.3    Cheng, H.P.4
  • 14
    • 84862804594 scopus 로고    scopus 로고
    • Structural, electronic and magnetic properties of single transition-metal adsorbed BN sheet: A density functional study
    • Li, J., Hu, M. L., Yu, Z., Zhong, J. X. & Sun, L. Z. Structural, electronic and magnetic properties of single transition-metal adsorbed BN sheet: A density functional study. Chem. Phys. Lett. 532, 40-46 (2012)
    • (2012) Chem. Phys. Lett. , vol.532 , pp. 40-46
    • Li, J.1    Hu, M.L.2    Yu, Z.3    Zhong, J.X.4    Sun, L.Z.5
  • 15
    • 84855402638 scopus 로고    scopus 로고
    • Transition-metal adatoms on graphene: Influence of local Coulomb interactions on chemical bonding and magnetic moments
    • Wehling, T. O., Lichtenstein, A. I. & Katsnelson, M. I. Transition-metal adatoms on graphene: Influence of local Coulomb interactions on chemical bonding and magnetic moments. Phys. Rev. B 84, 235110 (2011).
    • (2011) Phys. Rev. B , vol.84 , pp. 235110
    • Wehling, T.O.1    Lichtenstein, A.I.2    Katsnelson, M.I.3
  • 16
    • 80053080447 scopus 로고    scopus 로고
    • Magnetism of phthalocyanine-based organometallic single porous sheet
    • Zhou, J. & Sun, Q. Magnetism of phthalocyanine-based organometallic single porous sheet. J. Am. Chem. Soc. 133, 15113-15119 (2011).
    • (2011) J. Am. Chem. Soc. , vol.133 , pp. 15113-15119
    • Zhou, J.1    Sun, Q.2
  • 17
    • 0001009791 scopus 로고
    • Structure-property predictions for new planar forms of carbon: Layered phases containing sp 2 and sp atoms
    • Baughman, R. H., Eckhardt, H. & Kertesz, M. Structure-property predictions for new planar forms of carbon: Layered phases containing sp 2 and sp atoms. J. Chem. Phys. 87, 6687 (1987).
    • (1987) J. Chem. Phys. , vol.87 , pp. 6687
    • Baughman, R.H.1    Eckhardt, H.2    Kertesz, M.3
  • 18
    • 0000946635 scopus 로고    scopus 로고
    • Optimized geometries and electronic structures of graphyne and its family
    • Narita, N., Nagai, S., Suzuki, S. & Nakao, K. Optimized geometries and electronic structures of graphyne and its family. Phys. Rev. B 58, 11009 (1998).
    • (1998) Phys. Rev. B , vol.58 , pp. 11009
    • Narita, N.1    Nagai, S.2    Suzuki, S.3    Nakao, K.4
  • 19
    • 0000871591 scopus 로고    scopus 로고
    • Carbon networks based on dehydrobenzoannulenes. 3. Synthesis of graphyne substructures
    • Kehoe, J. M. et al. Carbon Networks Based on Dehydrobenzoannulenes. 3. Synthesis of Graphyne Substructures. Org. Lett. 2, 969-972 (2000).
    • (2000) Org. Lett. , vol.2 , pp. 969-972
    • Kehoe, J.M.1
  • 20
    • 34848843759 scopus 로고    scopus 로고
    • Carbon networks based on benzocyclynes. 6. Synthesis of graphyne substructures via directed alkyne metathesis
    • Johnson, C. A., II, Lu, Y. & Haley, M. M. Carbon Networks Based on Benzocyclynes. 6. Synthesis of Graphyne Substructures via Directed Alkyne Metathesis. Org. Lett. 9, 3725-3728 (2007).
    • (2007) Org. Lett. , vol.9 , pp. 3725-3728
    • Johnson, C.A.1    Lu, Y.2    Haley, M.M.3
  • 21
    • 77952000803 scopus 로고    scopus 로고
    • Architecture of graphdiyne nanoscale films
    • Li, G. et al. Architecture of graphdiyne nanoscale films. Chem. Commun. 46, 3256-3258 (2010).
    • (2010) Chem. Commun. , vol.46 , pp. 3256-3258
    • Li, G.1
  • 22
    • 78650474226 scopus 로고    scopus 로고
    • Aggregate nanostructures of organic molecular materials
    • Liu, H. B., Xu, J. L., Li, Y. J. & Li, Y. L. Aggregate Nanostructures of Organic Molecular Materials. Acc. Chem. Res. 43, 1496-1508 (2010).
    • (2010) Acc. Chem. Res. , vol.43 , pp. 1496-1508
    • Liu, H.B.1    Xu, J.L.2    Li, Y.J.3    Li, Y.L.4
  • 23
    • 84871605223 scopus 로고    scopus 로고
    • Magnetic properties of single transition-metal atom absorbed graphdiyne and graphyne sheet from DFT 1 U calculations
    • He, J. et al. Magnetic Properties of Single Transition-Metal Atom Absorbed Graphdiyne and Graphyne Sheet from DFT 1 U Calculations. J. Phys. Chem. C 116, 26313-26321(2012).
    • (2012) J. Phys. Chem. C , vol.116 , pp. 26313-26321
    • He, J.1
  • 24
    • 77955733841 scopus 로고    scopus 로고
    • RKKY coupling in graphene
    • Black-Schaffer, A. M. RKKY coupling in graphene. Phys. Rev. B 81, 205416(2010)
    • (2010) Phys. Rev. B , vol.81 , pp. 205416
    • Black-Schaffer, A.M.1
  • 25
    • 33846330138 scopus 로고    scopus 로고
    • Exchange interaction of magnetic impurities in graphene
    • Dugaev, V. K., Litvinov, V. I. & Barnas, J. Exchange interaction of magnetic impurities in graphene. Phys. Rev. B 74, 224438(2006)
    • (2006) Phys. Rev. B , vol.74 , pp. 224438
    • Dugaev, V.K.1    Litvinov, V.I.2    Barnas, J.3
  • 26
    • 77955751651 scopus 로고    scopus 로고
    • Electronic and magnetic properties of graphane nanoribbons
    • Sahin, H., Ataca, C. & Ciraci, S. Electronic and magnetic properties of graphane nanoribbons. Phys. Rev. B 81(20), 205417(2010).
    • (2010) Phys. Rev. B , vol.81 , Issue.20 , pp. 205417
    • Sahin, H.1    Ataca, C.2    Ciraci, S.3
  • 27
    • 33748674458 scopus 로고    scopus 로고
    • Organometallic benzene-vanadium wire: A one-dimensional half-metallic ferromagnet
    • Maslyuk, V. V. et al. Organometallic benzene-vanadium wire: A one-dimensional half-metallic ferromagnet. Phys. Rev. Lett. 97, 097201(2006).
    • (2006) Phys. Rev. Lett. , vol.97 , pp. 097201
    • Maslyuk, V.V.1
  • 28
    • 84876921208 scopus 로고    scopus 로고
    • Engineering intriguing electronic and magnetic properties in novel one-dimensional staircase-like metallocene wires
    • Ma, Y., Dai, Y., Wei, W. & Huang, B. Engineering intriguing electronic and magnetic properties in novel one-dimensional staircase-like metallocene wires. J. Mater. Chem. C 1, 941-946(2013).
    • (2013) J. Mater. Chem. C , vol.1 , pp. 941-946
    • Ma, Y.1    Dai, Y.2    Wei, W.3    Huang, B.4
  • 30
    • 84861832078 scopus 로고    scopus 로고
    • Effect of the electric field on magnetic properties of linear chains on a Pt (111) surface
    • Dasa, T. R., Ignatiev, P. A. & Stepanyuk, V. S. Effect of the electric field on magnetic properties of linear chains on a Pt (111) surface. Phys. Rev. B 85, 205447(2012).
    • (2012) Phys. Rev. B , vol.85 , pp. 205447
    • Dasa, T.R.1    Ignatiev, P.A.2    Stepanyuk, V.S.3
  • 31
    • 33645777389 scopus 로고    scopus 로고
    • Giant magnetocrystalline anisotropies of 4d transition-metal monowires
    • Mokrousov, Y., Bihlmayer, G., Heinze, S. & Blugel, S. Giant magnetocrystalline anisotropies of 4d transition-metal monowires. Phys. Rev. Lett. 96, 147201(2006).
    • (2006) Phys. Rev. Lett. , vol.96 , pp. 147201
    • Mokrousov, Y.1    Bihlmayer, G.2    Heinze, S.3    Blugel, S.4
  • 32
    • 34648843582 scopus 로고    scopus 로고
    • Systematic ab initio study of the magnetic and electronic properties of all 3d transition metal linear and zigzag nanowires
    • Tung, J. C. & Guo, G. Y. Systematic ab initio study of the magnetic and electronic properties of all 3d transition metal linear and zigzag nanowires. Phys. Rev. B 76, 094413(2007).
    • (2007) Phys. Rev. B , vol.76 , pp. 094413
    • Tung, J.C.1    Guo, G.Y.2
  • 34
    • 0033515812 scopus 로고    scopus 로고
    • Quantum phase interference and parity effects in magnetic molecular clusters
    • Wernsdorfer, W. & Sessoli, R. Quantum phase interference and parity effects in magnetic molecular clusters. Science 284, 133-135 (1999).
    • (1999) Science , vol.284 , pp. 133-135
    • Wernsdorfer, W.1    Sessoli, R.2
  • 35
    • 0037072645 scopus 로고    scopus 로고
    • Development of one-dimensional band structure in artificial gold chains
    • Nilius, N., Wallis, T. M. & Ho, W. Development of one-dimensional band structure in artificial gold chains. Science 297, 1853-1856 (2002).
    • (2002) Science , vol.297 , pp. 1853-1856
    • Nilius, N.1    Wallis, T.M.2    Ho, W.3
  • 36
    • 0037017927 scopus 로고    scopus 로고
    • Engineering electronic lifetimes in artificial atomic structures
    • Braun, K. F. & Rieder, K. H. Engineering electronic lifetimes in artificial atomic structures. Phys. Rev. Lett. 88, 096801(2002).
    • (2002) Phys. Rev. Lett. , vol.88 , pp. 096801
    • Braun, K.F.1    Rieder, K.H.2
  • 37
    • 79957599119 scopus 로고    scopus 로고
    • Realizing all-spin-based logic operations atom by atom
    • Khajetoorians, A. A., Wiebe, J., Chilian, B. & Wiesendanger, R. Realizing all-spin-based logic operations atom by atom. Science 332, 1062-1064 (2011).
    • (2011) Science , vol.332 , pp. 1062-1064
    • Khajetoorians, A.A.1    Wiebe, J.2    Chilian, B.3    Wiesendanger, R.4
  • 39
    • 34547350786 scopus 로고    scopus 로고
    • Electronic and transport properties of nanotubes
    • Charlier, J. C., Blase, X. & Roche, S. Electronic and transport properties of nanotubes. Rev. Mod. Phys. 79, 677-732 (2007).
    • (2007) Rev. Mod. Phys. , vol.79 , pp. 677-732
    • Charlier, J.C.1    Blase, X.2    Roche, S.3
  • 40
    • 82655188006 scopus 로고    scopus 로고
    • Half-metallic chromium-chain-embedded wire in graphene and carbon nanotubes
    • Yang, Y., Xiao, Y., Ren, W., Yan, X. H. & Pan, F. Half-metallic chromium-chain-embedded wire in graphene and carbon nanotubes. Phys. Rev. B 84, 195447 (2011).
    • (2011) Phys. Rev. B , vol.84 , pp. 195447
    • Yang, Y.1    Xiao, Y.2    Ren, W.3    Yan, X.H.4    Pan, F.5
  • 42
    • 65449167968 scopus 로고    scopus 로고
    • Ferromagnetism of undoped GaN mediated by through-bond spin polarization between nitrogen dangling bonds
    • Jin, H., Dai, Y., Huang, B. & Whangbo, M. H. Ferromagnetism of undoped GaN mediated by through-bond spin polarization between nitrogen dangling bonds. Appl. Phys. Lett. 94, 162505 (2009)
    • (2009) Appl. Phys. Lett. , vol.94 , pp. 162505
    • Jin, H.1    Dai, Y.2    Huang, B.3    Whangbo, M.H.4
  • 43
    • 84863229764 scopus 로고    scopus 로고
    • Evidence of the existence of magnetism in pristine VX2 monolayers (X 5 S, Se) and their strain-induced tunable magnetic properties
    • Ma, Y. et al. Evidence of the Existence of Magnetism in Pristine VX2 Monolayers (X 5 S, Se) and Their Strain-Induced Tunable Magnetic Properties. ACS nano 6, 1695-1701(2012).
    • (2012) ACS Nano , vol.6 , pp. 1695-1701
    • Ma, Y.1
  • 44
    • 33847802449 scopus 로고
    • Orbital interactions in metal dimer complexes
    • Hay, P. J., Thibeault, J. C. & Hoffmann, R. Orbital interactions in metal dimer complexes. J. Am. Chem. Soc. 97, 4884-4899 (1975).
    • (1975) J. Am. Chem. Soc. , vol.97 , pp. 4884-4899
    • Hay, P.J.1    Thibeault, J.C.2    Hoffmann, R.3
  • 46
    • 67650132868 scopus 로고    scopus 로고
    • Magnetic anisotropy of transition-metal dimers: Density functional calculations
    • Blonski, P. & Hafner, J. Magnetic anisotropy of transition-metal dimers: Density functional calculations. Phys. Rev. B 79, 224418(2009).
    • (2009) Phys. Rev. B , vol.79 , pp. 224418
    • Blonski, P.1    Hafner, J.2
  • 47
    • 67049115762 scopus 로고    scopus 로고
    • Preparing spin-polarized scanning tunneling microscope probes on capped carbon nanotubes by Fe doping: A first-principles study
    • Zou, X. et al. Preparing spin-polarized scanning tunneling microscope probes on capped carbon nanotubes by Fe doping: A first-principles study. Appl. Phys. Lett. 94, 193106 (2009).
    • (2009) Appl. Phys. Lett. , vol.94 , pp. 193106
    • Zou, X.1
  • 48
    • 70350504150 scopus 로고    scopus 로고
    • Co dimers on hexagonal carbon rings proposed as subnanometer magnetic storage bits
    • Xiao, R. et al. Co dimers on hexagonal carbon rings proposed as subnanometer magnetic storage bits. Phys. Rev. Lett. 103, 187201(2009).
    • (2009) Phys. Rev. Lett. , vol.103 , pp. 187201
    • Xiao, R.1
  • 49
    • 50149089974 scopus 로고    scopus 로고
    • Effects of spin orbit coupling on magnetic properties of discrete and extended magnetic systems
    • Dai, D., Xiang, H. & Whangbo, M. H. Effects of spin orbit coupling on magnetic properties of discrete and extended magnetic systems. J. Comput. Chem. 29, 2187-2209(2008).
    • (2008) J. Comput. Chem. , vol.29 , pp. 2187-2209
    • Dai, D.1    Xiang, H.2    Whangbo, M.H.3
  • 50
    • 2442537377 scopus 로고    scopus 로고
    • Efficient iterative schemes for ab initio total-energy calculations using a plane-wave basis set
    • Kresse, G. & Furthmuller, J. Efficient iterative schemes for ab initio total-energy calculations using a plane-wave basis set. Phys. Rev. B 54, 11169(1996).
    • (1996) Phys. Rev. B , vol.54 , pp. 11169
    • Kresse, G.1    Furthmuller, J.2
  • 51
    • 0030190741 scopus 로고    scopus 로고
    • Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set
    • Kresse, G. & Furthmuller, J. Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set. Comput. Matter. Sci. 6, 15-50 (1996).
    • (1996) Comput. Matter. Sci. , vol.6 , pp. 15-50
    • Kresse, G.1    Furthmuller, J.2
  • 52
    • 10644250257 scopus 로고
    • Inhomogeneous electron gas
    • Hohenberg, P. & Kohn, W. Inhomogeneous electron gas. Phys. Rev. 136, B864-B871 (1964).
    • (1964) Phys. Rev. , vol.136 , pp. B864-B871
    • Hohenberg, P.1    Kohn, W.2
  • 53
    • 0042113153 scopus 로고
    • Self-consistent equations including exchange and correlation effects
    • Kohn, W. & Sham, L. J. Self-consistent equations including exchange and correlation effects. Phys. Rev. 140, A1133-A11389 (1965).
    • (1965) Phys. Rev. , vol.140 , pp. A1133-A11389
    • Kohn, W.1    Sham, L.J.2
  • 54
    • 0010636925 scopus 로고    scopus 로고
    • First-principles calculations of the electronic structure and spectra of strongly correlated systems: The LDA 1 U method
    • Anisimov, V. I., Aryasetiawan, F. & Lichtenstein, A. I. First-principles calculations of the electronic structure and spectra of strongly correlated systems: the LDA 1 U method. J. Phys.: Condens. Matter 9, 7679(1997).
    • (1997) J. Phys.: Condens. Matter , vol.9 , pp. 7679
    • Anisimov, V.I.1    Aryasetiawan, F.2    Lichtenstein, A.I.3
  • 55
    • 4243943295 scopus 로고    scopus 로고
    • Generalized gradient approximation made simple
    • Perdew, J. P., Burke, K. & Ernzerhof, M. Generalized gradient approximation made simple. Phys. Rev. Lett. 77, 3865 (1996).
    • (1996) Phys. Rev. Lett. , vol.77 , pp. 3865
    • Perdew, J.P.1    Burke, K.2    Ernzerhof, M.3
  • 56
    • 25744460922 scopus 로고
    • Projector augmented-wave method
    • Blochl, P. E. Projector augmented-wave method. Phys. Rev. B 50, 17953(1994).
    • (1994) Phys. Rev. B , vol.50 , pp. 17953
    • Blochl, P.E.1
  • 57
    • 0011236321 scopus 로고    scopus 로고
    • From ultrasoft pseudopotentials to the projector augmented-wave method
    • Kresse, G. & Joubert, D. From ultrasoft pseudopotentials to the projector augmented-wave method. Phys. Rev. B 59, 17589(1999).
    • (1999) Phys. Rev. B , vol.59 , pp. 17589
    • Kresse, G.1    Joubert, D.2
  • 58
    • 33748606013 scopus 로고
    • Adsorbate-substrate and adsorbate-adsorbate interactions of Na and K adlayers on Al (111)
    • Neugebauer, J. & Scheffler, M. Adsorbate-substrate and adsorbate-adsorbate interactions of Na and K adlayers on Al (111). Phys. Rev. B 46, 16067 (1992).
    • (1992) Phys. Rev. B , vol.46 , pp. 16067
    • Neugebauer, J.1    Scheffler, M.2
  • 59
    • 0001486791 scopus 로고    scopus 로고
    • Electron-energy-loss spectra and the structural stability of nickel oxide: An LSDA 1 U study
    • Dudarev, S. L., Botton, G. A., Savrasov, S. Y., Humphreys, C. J. & Sutton, A. P. (1998). Electron-energy-loss spectra and the structural stability of nickel oxide: An LSDA 1 U study. Phys. Rev. B 57, 1505 (1998).
    • (1998) Phys. Rev. B , vol.57 , pp. 1505
    • Dudarev, S.L.1    Botton, G.A.2    Savrasov, S.Y.3    Humphreys, C.J.4    Sutton, A.P.5
  • 60
    • 77953579305 scopus 로고    scopus 로고
    • Electronic structure of substitutionally Mn-doped graphene
    • Wu, M., Cao, C. & Jiang, J. Z. Electronic structure of substitutionally Mn-doped graphene. New J. Phys. 12, 063020(2010).
    • (2010) New J. Phys. , vol.12 , pp. 063020
    • Wu, M.1    Cao, C.2    Jiang, J.Z.3
  • 61
    • 15444366598 scopus 로고    scopus 로고
    • Linear response approach to the calculation of the effective interaction parameters in the LDA 1 U method
    • Cococcioni, M. & de Gironcoli, S. Linear response approach to the calculation of the effective interaction parameters in the LDA 1 U method. Phys. Rev. B 71, 035105 (2005).
    • (2005) Phys. Rev. B , vol.71 , pp. 035105
    • Cococcioni, M.1    De Gironcoli, S.2


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.