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Volumn 117, Issue 44, 2013, Pages 23364-23371

Transition metal (Fe and Cr) adsorptions on buckled and planar silicene monolayers: A density functional theory investigation

Author keywords

[No Author keywords available]

Indexed keywords

3D TRANSITION METALS; BONDING INTERACTIONS; DISTRIBUTION RATIO; FERROMAGNETIC MOMENTS; FIRST-PRINCIPLES CALCULATION; SPIN-ELECTRONIC DEVICES; STABLE STRUCTURES; STRUCTURAL STABILITIES;

EID: 84889815493     PISSN: 19327447     EISSN: 19327455     Source Type: Journal    
DOI: 10.1021/jp407601d     Document Type: Article
Times cited : (34)

References (32)
  • 4
    • 72449171191 scopus 로고    scopus 로고
    • Monolayer Honeycomb Structures of Group-IV Elements and III-V Binary Compounds: First-Principles Calculations
    • Şahin, H.; Cahangirov, S.; Topsakal, M.; Bekaroglu, E.; Akturk, E.; Senger, R.; Ciraci, S. Monolayer Honeycomb Structures of Group-IV Elements and III-V Binary Compounds: First-Principles Calculations Phys. Rev. B 2009, 80, 155453
    • (2009) Phys. Rev. B , vol.80 , pp. 155453
    • Şahin, H.1    Cahangirov, S.2    Topsakal, M.3    Bekaroglu, E.4    Akturk, E.5    Senger, R.6    Ciraci, S.7
  • 5
    • 34548452627 scopus 로고    scopus 로고
    • Electronic Structure of Silicon-Based Nanostructures
    • Guzmán-Verri, G.; Lew Yan Voon, L. Electronic Structure of Silicon-Based Nanostructures Phys. Rev. B 2007, 76, 075131
    • (2007) Phys. Rev. B , vol.76 , pp. 075131
    • Guzmán-Verri, G.1    Lew Yan Voon, L.2
  • 12
    • 84863821551 scopus 로고    scopus 로고
    • Evidence of Silicene in Honeycomb Structures of Silicon on Ag(111)
    • Feng, B.; Ding, Z.; Meng, S.; Yao, Y.; He, X.; Cheng, P.; Chen, L.; Wu, K. Evidence of Silicene in Honeycomb Structures of Silicon on Ag(111) Nano Lett. 2012, 12, 3507
    • (2012) Nano Lett. , vol.12 , pp. 3507
    • Feng, B.1    Ding, Z.2    Meng, S.3    Yao, Y.4    He, X.5    Cheng, P.6    Chen, L.7    Wu, K.8
  • 14
    • 10644250257 scopus 로고
    • Inhomogeneous Electron Gas
    • Hohenberg, P.; Kohn, W. Inhomogeneous Electron Gas Phys. Rev. 1964, 136, B864-B871
    • (1964) Phys. Rev. , vol.136
    • Hohenberg, P.1    Kohn, W.2
  • 15
    • 84874531644 scopus 로고    scopus 로고
    • Adsorption of Alkali, Alkaline-earth, and 3d Transition Metal Atoms on Silicene
    • Sahin, H.; Peeters, F. M. Adsorption of Alkali, Alkaline-earth, and 3d Transition Metal Atoms on Silicene Phys. Rev. B 2013, 87, 085423
    • (2013) Phys. Rev. B , vol.87 , pp. 085423
    • Sahin, H.1    Peeters, F.M.2
  • 17
    • 84866124162 scopus 로고    scopus 로고
    • The Electronic and Magnetic Properties of Functionalized Silicene: A First-Principles Study
    • Zhang, C.-w.; Zheng, F.-b. The Electronic and Magnetic Properties of Functionalized Silicene: A First-Principles Study Nanoscale Res. Lett. 2012, 7, 422
    • (2012) Nanoscale Res. Lett. , vol.7 , pp. 422
    • Zhang, C.-W.1
  • 18
    • 0042511083 scopus 로고
    • Spin-Density-Wave Antiferromagnetism in Chromium
    • Fawcett, E. Spin-Density-Wave Antiferromagnetism in Chromium Rev. Mod. Phys. 1988, 60, 209
    • (1988) Rev. Mod. Phys. , vol.60 , pp. 209
    • Fawcett, E.1
  • 19
    • 84874145934 scopus 로고    scopus 로고
    • Graphene-Cr-Graphene Intercalation Nanostructures: Stability and Magnetic Properties from Density Functional Theory Investigations
    • Bui, V. Q.; Le, H. M.; Kawazoe, Y.; Nguyen-Manh, D. Graphene-Cr-Graphene Intercalation Nanostructures: Stability and Magnetic Properties from Density Functional Theory Investigations J. Phys. Chem. C 2013, 117, 3605
    • (2013) J. Phys. Chem. C , vol.117 , pp. 3605
    • Bui, V.Q.1    Le, H.M.2    Kawazoe, Y.3    Nguyen-Manh, D.4
  • 20
    • 78649430750 scopus 로고    scopus 로고
    • Migration of Adatom Adsorption on Graphene Using DFT Calculation
    • Nakada, K.; Ishii, A. Migration of Adatom Adsorption on Graphene Using DFT Calculation Solid State Commun. 2011, 151, 13
    • (2011) Solid State Commun. , vol.151 , pp. 13
    • Nakada, K.1    Ishii, A.2
  • 24
    • 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. 1996, 77, 3865
    • (1996) Phys. Rev. Lett. , vol.77 , pp. 3865
    • Perdew, J.P.1    Burke, K.2    Ernzerhof, M.3
  • 25
    • 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. 1996, 77, 3865
    • (1996) Phys. Rev. Lett. , vol.77 , pp. 3865
    • Perdew, J.P.1    Burke, K.2    Ernzerhof, M.3
  • 26
    • 4944232881 scopus 로고    scopus 로고
    • Phys. Rev. Lett. 1997, 78, 1396.
    • (1997) Phys. Rev. Lett. , vol.78 , pp. 1396
  • 27
    • 20544463457 scopus 로고
    • Soft Self-Consistent Pseudopotentials in a Generalized Eigenvalue Formalism
    • Vanderbilt, D. Soft Self-Consistent Pseudopotentials in a Generalized Eigenvalue Formalism Phys. Rev. B 1990, 41, 7892
    • (1990) Phys. Rev. B , vol.41 , pp. 7892
    • Vanderbilt, D.1
  • 28
    • 0035894105 scopus 로고    scopus 로고
    • Density-Functional Perturbation Theory with Ultrasoft Pseudopotentials
    • Dal Corso, A. Density-Functional Perturbation Theory with Ultrasoft Pseudopotentials Phys. Rev. B 2001, 64, 235118
    • (2001) Phys. Rev. B , vol.64 , pp. 235118
    • Dal Corso, A.1
  • 30
    • 0022059969 scopus 로고
    • An Example of Numerical Nonconvergence of a Variable-Metric Method
    • Shanno, D. F. An Example of Numerical Nonconvergence of a Variable-Metric Method J. Optim. Theory Appl. 1985, 46, 87-94
    • (1985) J. Optim. Theory Appl. , vol.46 , pp. 87-94
    • Shanno, D.F.1
  • 31
    • 3543147072 scopus 로고    scopus 로고
    • Measuring the Spin Polarization of a Metal with a Superconducting Point Contact
    • Soulen, R. J., Jr. Measuring the Spin Polarization of a Metal with a Superconducting Point Contact Science 1998, 282, 85-88
    • (1998) Science , vol.282 , pp. 85-88
    • Soulen, Jr.R.J.1
  • 32
    • 33746485436 scopus 로고
    • Electronegativity Values from Thermochemical Data
    • Allred, A. L. Electronegativity Values from Thermochemical Data J. Inorg. Nucl. Chem. 1961, 17, 215-221
    • (1961) J. Inorg. Nucl. Chem. , vol.17 , pp. 215-221
    • Allred, A.L.1


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.