메뉴 건너뛰기




Volumn 119, Issue 45, 2015, Pages 25209-25219

GW Band Structures and Carrier Effective Masses of CH3NH3PbI3 and Hypothetical Perovskites of the Type APbI3: A = NH4, PH4, AsH4, and SbH4

Author keywords

[No Author keywords available]

Indexed keywords

BAND STRUCTURE; ENERGY GAP; METAL HALIDES; OPEN CIRCUIT VOLTAGE; OPTICAL PROPERTIES; OPTOELECTRONIC DEVICES; PEROVSKITE; SOLAR POWER GENERATION;

EID: 84946854860     PISSN: 19327447     EISSN: 19327455     Source Type: Journal    
DOI: 10.1021/acs.jpcc.5b07891     Document Type: Article
Times cited : (177)

References (105)
  • 1
    • 84929154162 scopus 로고    scopus 로고
    • Metal-Halide Perovskites for Photovoltaic and Light-Emitting Devices
    • Stranks, S.; Snaith, H. J. Metal-Halide Perovskites for Photovoltaic and Light-Emitting Devices Nat. Nanotechnol. 2015, 10, 391-402 10.1038/nnano.2015.90
    • (2015) Nat. Nanotechnol. , vol.10 , pp. 391-402
    • Stranks, S.1    Snaith, H.J.2
  • 2
    • 84906568160 scopus 로고    scopus 로고
    • The Light and Shade of Perovskite Solar Cells
    • Grätzel, M. The Light and Shade of Perovskite Solar Cells Nat. Mater. 2014, 13, 838-842 10.1038/nmat4065
    • (2014) Nat. Mater. , vol.13 , pp. 838-842
    • Grätzel, M.1
  • 3
    • 84903544471 scopus 로고    scopus 로고
    • The Emergence of Perovskite Solar Cells
    • Green, M.; Ho-Baillie, A.; Snaith, H. J. The Emergence of Perovskite Solar Cells Nat. Photonics 2014, 8, 506-514 10.1038/nphoton.2014.134
    • (2014) Nat. Photonics , vol.8 , pp. 506-514
    • Green, M.1    Ho-Baillie, A.2    Snaith, H.J.3
  • 4
    • 84904548734 scopus 로고    scopus 로고
    • Advancements in Perovskite Solar Cells: Photophysics Behind the Photovoltaics
    • Sum, T. C.; Mathews, N. Advancements in Perovskite Solar Cells: Photophysics Behind the Photovoltaics Energy Environ. Sci. 2014, 7, 2518-2534 10.1039/C4EE00673A
    • (2014) Energy Environ. Sci. , vol.7 , pp. 2518-2534
    • Sum, T.C.1    Mathews, N.2
  • 5
    • 84904544997 scopus 로고    scopus 로고
    • Organohalide Lead Perovskites for Photovoltaic Applications
    • Gao, P.; Grätzel, M.; Nazeeruddin, M. K. Organohalide Lead Perovskites for Photovoltaic Applications Energy Environ. Sci. 2014, 7, 2448-2463 10.1039/C4EE00942H
    • (2014) Energy Environ. Sci. , vol.7 , pp. 2448-2463
    • Gao, P.1    Grätzel, M.2    Nazeeruddin, M.K.3
  • 10
    • 84930225544 scopus 로고    scopus 로고
    • Bright Visible-Onfrared Light Emitting Diodes Based on Hybrid Halide Perovskite with Spiro-OMeTAD as a Hole-Injecting Layer
    • Jaramillo-Quintero, O. A.; Sanchez, R. S.; Rincon, M.; Mora-Sero, I. Bright Visible-Onfrared Light Emitting Diodes Based on Hybrid Halide Perovskite with Spiro-OMeTAD as a Hole-Injecting Layer J. Phys. Chem. Lett. 2015, 6, 1883-1890 10.1021/acs.jpclett.5b00732
    • (2015) J. Phys. Chem. Lett. , vol.6 , pp. 1883-1890
    • Jaramillo-Quintero, O.A.1    Sanchez, R.S.2    Rincon, M.3    Mora-Sero, I.4
  • 12
    • 0033615351 scopus 로고    scopus 로고
    • Organic-Inorganic Hybrid Materials as Semiconducting Channels in Thin-Film Field-Effect Transistors
    • Kagan, C. R.; Mitzi, D. B.; Dimitrakopoulos, C. D. Organic-Inorganic Hybrid Materials as Semiconducting Channels in Thin-Film Field-Effect Transistors Science 1999, 286, 945-947 10.1126/science.286.5441.945
    • (1999) Science , vol.286 , pp. 945-947
    • Kagan, C.R.1    Mitzi, D.B.2    Dimitrakopoulos, C.D.3
  • 13
    • 84941279029 scopus 로고    scopus 로고
    • Electrostatic Gating of Hybrid Halide Perovskite Field-Effect Transistors: balanced ambipolar transport at room-temperature
    • Mei, Y.; Jurchescu, O. D.; Zhang, C.; Vardeny, Z. V. Electrostatic Gating of Hybrid Halide Perovskite Field-Effect Transistors: balanced ambipolar transport at room-temperature MRS Commun. 2015, 5, 297-301 10.1557/mrc.2015.21
    • (2015) MRS Commun. , vol.5 , pp. 297-301
    • Mei, Y.1    Jurchescu, O.D.2    Zhang, C.3    Vardeny, Z.V.4
  • 15
    • 84904133655 scopus 로고    scopus 로고
    • Hybrid Lead Halide Iodide and Lead Halide Bromide in Efficient Hole Conductor Free Perovskite Solar Cell
    • Aharon, S.; Cohen, B. E.; Etgar, L. Hybrid Lead Halide Iodide and Lead Halide Bromide in Efficient Hole Conductor Free Perovskite Solar Cell J. Phys. Chem. C 2014, 118, 17160-17165 10.1021/jp5023407
    • (2014) J. Phys. Chem. C , vol.118 , pp. 17160-17165
    • Aharon, S.1    Cohen, B.E.2    Etgar, L.3
  • 16
    • 84868195671 scopus 로고    scopus 로고
    • Efficient Hybrid Solar Cells Based on Meso-Superstructured Organometal Halide Perovskites
    • Lee, M. M.; Teuscher, J.; Miyasaka, T.; Murakami, T. N.; Snaith, H. J. Efficient Hybrid Solar Cells Based on Meso-Superstructured Organometal Halide Perovskites Science 2012, 338, 643-647 10.1126/science.1228604
    • (2012) Science , vol.338 , pp. 643-647
    • Lee, M.M.1    Teuscher, J.2    Miyasaka, T.3    Murakami, T.N.4    Snaith, H.J.5
  • 17
    • 84896108049 scopus 로고    scopus 로고
    • High Efficiency Perovskite Solar Cells: From Complex Nanostructure to Planar Heterojunction
    • He, M.; Zheng, D.; Wang, M.; Lin, C.; Lin, Z. High Efficiency Perovskite Solar Cells: From Complex Nanostructure to Planar Heterojunction J. Mater. Chem. A 2014, 2, 5994-6003 10.1039/C3TA14160H
    • (2014) J. Mater. Chem. A , vol.2 , pp. 5994-6003
    • He, M.1    Zheng, D.2    Wang, M.3    Lin, C.4    Lin, Z.5
  • 18
    • 0006483573 scopus 로고
    • High-Efficiency Solar Cell Based on Dye Sensitized Colloidal TiO2 Films
    • O'Regan, B.; Grätzel, M. High-Efficiency Solar Cell Based on Dye Sensitized Colloidal TiO2 Films Nature 1991, 353, 737-740 10.1038/353737a0
    • (1991) Nature , vol.353 , pp. 737-740
    • O'Regan, B.1    Grätzel, M.2
  • 20
    • 84878838031 scopus 로고    scopus 로고
    • Low-Temperature Processed Meso-Superstructured to Thin Film Solar Cells
    • Ball, J. M.; Lee, M. M.; Hey, A.; Snaith, H. J. Low-Temperature Processed Meso-Superstructured to Thin Film Solar Cells Energy Environ. Sci. 2013, 6, 1739-1743 10.1039/c3ee40810h
    • (2013) Energy Environ. Sci. , vol.6 , pp. 1739-1743
    • Ball, J.M.1    Lee, M.M.2    Hey, A.3    Snaith, H.J.4
  • 21
    • 84884411335 scopus 로고    scopus 로고
    • Efficient Planar Heterojunction Perovskite Solar Cells by Vapour Deposition
    • Liu, M.; Johnston, M. B.; Snaith, H. J. Efficient Planar Heterojunction Perovskite Solar Cells by Vapour Deposition Nature 2013, 501, 395-398 10.1038/nature12509
    • (2013) Nature , vol.501 , pp. 395-398
    • Liu, M.1    Johnston, M.B.2    Snaith, H.J.3
  • 22
    • 84893299607 scopus 로고    scopus 로고
    • Perovskite Solar Cells with a Planar Heterojunction Structure Prepared Using Room-Temperature Solution Processing Techniques
    • Liu, D.; Kelly, T. L. Perovskite Solar Cells with a Planar Heterojunction Structure Prepared Using Room-Temperature Solution Processing Techniques Nat. Photonics 2014, 8, 133-138 10.1038/nphoton.2013.342
    • (2014) Nat. Photonics , vol.8 , pp. 133-138
    • Liu, D.1    Kelly, T.L.2
  • 24
    • 84880507645 scopus 로고    scopus 로고
    • Sequential Deposition as a Route to High-Performance Perovskite-Sensitized Solar Cells
    • Burschka, J.; Pellet, N.; Moon, S.-J.; Humphry-Baker, R.; Gao, P.; Nazeeruddin, M. K.; Grätzel, M. Sequential Deposition as a Route to High-Performance Perovskite-Sensitized Solar Cells Nature 2013, 499, 316-319 10.1038/nature12340
    • (2013) Nature , vol.499 , pp. 316-319
    • Burschka, J.1    Pellet, N.2    Moon, S.-J.3    Humphry-Baker, R.4    Gao, P.5    Nazeeruddin, M.K.6    Grätzel, M.7
  • 25
    • 84876029268 scopus 로고    scopus 로고
    • Chemical Management for Colorful, Efficient and Stable Inorganic-Organic Hybrid Nanostructured Solar Cells
    • Noh, J. H.; Im, S. H.; Heo, J. H.; Mandal, T. N.; Seok, S. I. Chemical Management for Colorful, Efficient and Stable Inorganic-Organic Hybrid Nanostructured Solar Cells Nano Lett. 2013, 13, 1764-1769 10.1021/nl400349b
    • (2013) Nano Lett. , vol.13 , pp. 1764-1769
    • Noh, J.H.1    Im, S.H.2    Heo, J.H.3    Mandal, T.N.4    Seok, S.I.5
  • 26
    • 84901695701 scopus 로고    scopus 로고
    • Lead-Free Solid-State Organic-Inorganic Halide Perovskite Solar Cells
    • Hao, F.; Stoumpos, C. C.; Cao, D. H.; Chang, R. P. H.; Kanatzidis, M. G. Lead-Free Solid-State Organic-Inorganic Halide Perovskite Solar Cells Nat. Photonics 2014, 8, 489-494 10.1038/nphoton.2014.82
    • (2014) Nat. Photonics , vol.8 , pp. 489-494
    • Hao, F.1    Stoumpos, C.C.2    Cao, D.H.3    Chang, R.P.H.4    Kanatzidis, M.G.5
  • 27
    • 84901937010 scopus 로고    scopus 로고
    • Anomalous Band Gap Behavior in Mixed Sn and Pb Perovskites Enables Broadening of the Absorbtion Spectrum in Solar Cells
    • Hao, F.; Stoumpos, C. C.; Chang, R. P. H.; Kanatzidis, M. G. Anomalous Band Gap Behavior in Mixed Sn and Pb Perovskites Enables Broadening of the Absorbtion Spectrum in Solar Cells J. Am. Chem. Soc. 2014, 136, 8094-8099 10.1021/ja5033259
    • (2014) J. Am. Chem. Soc. , vol.136 , pp. 8094-8099
    • Hao, F.1    Stoumpos, C.C.2    Chang, R.P.H.3    Kanatzidis, M.G.4
  • 29
  • 30
    • 84922586427 scopus 로고    scopus 로고
    • Compositional Engineering of Perovskite Materials for High-Performance Solar Cells
    • Jeon, N. J.; Noh, J. H.; Yang, W. S.; Kim, Y. C.; Ryu, S.; Seo, J.; Seok, S. I. Compositional Engineering of Perovskite Materials for High-Performance Solar Cells Nature 2015, 517, 476-480 10.1038/nature14133
    • (2015) Nature , vol.517 , pp. 476-480
    • Jeon, N.J.1    Noh, J.H.2    Yang, W.S.3    Kim, Y.C.4    Ryu, S.5    Seo, J.6    Seok, S.I.7
  • 31
    • 84923350347 scopus 로고    scopus 로고
    • Steric Engineering of Metal-Halide Perovskites with Tunable Optical Band Gaps
    • Filip, M. R.; Eperon, G.; Snaith, H. J.; Giustino, F. Steric Engineering of Metal-Halide Perovskites with Tunable Optical Band Gaps Nat. Commun. 2014, 5, 5757 10.1038/ncomms6757
    • (2014) Nat. Commun. , vol.5 , pp. 5757
    • Filip, M.R.1    Eperon, G.2    Snaith, H.J.3    Giustino, F.4
  • 34
    • 84896662777 scopus 로고    scopus 로고
    • Interface Energetics in Organo-Metal Halide Perovskite-Based Photovoltaic Cells
    • Schulz, P.; Edri, E.; Kirmayer, S.; Hodes, G.; Cahen, D.; Kahn, A. Interface Energetics in Organo-Metal Halide Perovskite-Based Photovoltaic Cells Energy Environ. Sci. 2014, 7, 1377-1381 10.1039/c4ee00168k
    • (2014) Energy Environ. Sci. , vol.7 , pp. 1377-1381
    • Schulz, P.1    Edri, E.2    Kirmayer, S.3    Hodes, G.4    Cahen, D.5    Kahn, A.6
  • 35
    • 84934863500 scopus 로고    scopus 로고
    • Direct Measurement of the Exciton Binding Energy and Effective Masses for Charge Carriers in an Organic-Inorganic Tri-Halide Perovskite
    • Miyata, A.; Mitioglu, A.; Plochocka, P.; Portugall, O.; Wang, J. T.-W.; Stranks, S. D.; Snaith, H. J.; Nicholas, R. J. Direct Measurement of the Exciton Binding Energy and Effective Masses for Charge Carriers in an Organic-Inorganic Tri-Halide Perovskite Nat. Phys. 2015, 11, 582-587 10.1038/nphys3357
    • (2015) Nat. Phys. , vol.11 , pp. 582-587
    • Miyata, A.1    Mitioglu, A.2    Plochocka, P.3    Portugall, O.4    Wang, J.T.-W.5    Stranks, S.D.6    Snaith, H.J.7    Nicholas, R.J.8
  • 41
    • 84895922206 scopus 로고    scopus 로고
    • High Charge Carrier Mobilities and Lifetimes in Organolead Trihalide Perovskites
    • Wehrenfennig, C.; Eperon, G. E.; Johnston, M. B.; Snaith, H. J.; Herz, L. M. High Charge Carrier Mobilities and Lifetimes in Organolead Trihalide Perovskites Adv. Mater. 2014, 26, 1584-1589 10.1002/adma.201305172
    • (2014) Adv. Mater. , vol.26 , pp. 1584-1589
    • Wehrenfennig, C.1    Eperon, G.E.2    Johnston, M.B.3    Snaith, H.J.4    Herz, L.M.5
  • 43
    • 84880147648 scopus 로고    scopus 로고
    • First-Principles Modeling of Mixed Halide Organometal Perovskite of Photovoltaic Applications
    • Mosconi, E.; Amat, A.; Nazeeruddin, M. K.; Grätzel, M.; De Angelis, F. First-Principles Modeling of Mixed Halide Organometal Perovskite of Photovoltaic Applications J. Phys. Chem. C 2013, 117, 13902-13913 10.1021/jp4048659
    • (2013) J. Phys. Chem. C , vol.117 , pp. 13902-13913
    • Mosconi, E.1    Amat, A.2    Nazeeruddin, M.K.3    Grätzel, M.4    De Angelis, F.5
  • 44
    • 84883806970 scopus 로고    scopus 로고
    • Importance of Spin-Orbit Coupling in Hybrid Organic/Inorganic Perovskites for Photovoltaic Applications
    • Even, J.; Pedesseau, L.; Jancu, J.-M.; Katan, C. Importance of Spin-Orbit Coupling in Hybrid Organic/Inorganic Perovskites for Photovoltaic Applications J. Phys. Chem. Lett. 2013, 4, 2999-3005 10.1021/jz401532q
    • (2013) J. Phys. Chem. Lett. , vol.4 , pp. 2999-3005
    • Even, J.1    Pedesseau, L.2    Jancu, J.-M.3    Katan, C.4
  • 47
    • 84899727290 scopus 로고    scopus 로고
    • Relativistic Quasiparticle Self-Consistent Electronic Structure of Hybrid Halide Perovskite Photovoltaic Absorbers
    • Brivio, F.; Butler, K. T.; Walsh, A.; van Schilfgaarde, M. Relativistic Quasiparticle Self-Consistent Electronic Structure of Hybrid Halide Perovskite Photovoltaic Absorbers Phys. Rev. B: Condens. Matter Mater. Phys. 2014, 89, 155204 10.1103/PhysRevB.89.155204
    • (2014) Phys. Rev. B: Condens. Matter Mater. Phys. , vol.89 , pp. 155204
    • Brivio, F.1    Butler, K.T.2    Walsh, A.3    Van Schilfgaarde, M.4
  • 48
    • 84961290625 scopus 로고    scopus 로고
    • 3: Effect of Spin-Orbit Interaction, Semicore Electrons, and Self-Consistency
    • 3: Effect of Spin-Orbit Interaction, Semicore Electrons, and Self-Consistency Phys. Rev. B: Condens. Matter Mater. Phys. 2014, 90, 245145 10.1103/PhysRevB.90.245145
    • (2014) Phys. Rev. B: Condens. Matter Mater. Phys. , vol.90 , pp. 245145
    • Filip, M.R.1    Giustino, F.2
  • 49
    • 0037821300 scopus 로고
    • Dynamic Disorder in Methylammoniumtrihalogenoplumbates (II) Observed by Millimeter-Wave Spectroscopy
    • Poglitsch, A.; Weber, D. Dynamic Disorder in Methylammoniumtrihalogenoplumbates (II) Observed by Millimeter-Wave Spectroscopy J. Chem. Phys. 1987, 87, 6373 10.1063/1.453467
    • (1987) J. Chem. Phys. , vol.87 , pp. 6373
    • Poglitsch, A.1    Weber, D.2
  • 50
    • 84881184996 scopus 로고    scopus 로고
    • Semiconducting Tin and Lead Iodide Perovskites with Organic Cations: Phase Transitions, High Mobilities, and Near-Infrared Photoluminescent Properties
    • Stoumpos, C. C.; Malliakas, C. D.; Kanatzidis, M. G. Semiconducting Tin and Lead Iodide Perovskites with Organic Cations: Phase Transitions, High Mobilities, and Near-Infrared Photoluminescent Properties Inorg. Chem. 2013, 52, 9019-9038 10.1021/ic401215x
    • (2013) Inorg. Chem. , vol.52 , pp. 9019-9038
    • Stoumpos, C.C.1    Malliakas, C.D.2    Kanatzidis, M.G.3
  • 51
    • 84923869956 scopus 로고    scopus 로고
    • Complete Structure and Cation Orientation in the Perovskite Photovoltaic Methylammonium Lead Iodide between 100 and 352 K
    • Weller, M. T.; Weber, O. J.; Henry, P. F.; Di Pumpo, A. M.; Hansen, H. C. Complete Structure and Cation Orientation in the Perovskite Photovoltaic Methylammonium Lead Iodide between 100 and 352 K Chem. Commun. 2015, 51, 4180-4183 10.1039/C4CC09944C
    • (2015) Chem. Commun. , vol.51 , pp. 4180-4183
    • Weller, M.T.1    Weber, O.J.2    Henry, P.F.3    Di Pumpo, A.M.4    Hansen, H.C.5
  • 52
    • 84892170004 scopus 로고    scopus 로고
    • Structure of Methylammonium Lead Iodide within Mesoporous Titanium Dioxide: Active Material in High-Performance Perovskite Solar Cells
    • Choi, J. J.; Yang, X.; Norman, Z. M.; Billinge, S. J. L.; Owen, J. S. Structure of Methylammonium Lead Iodide within Mesoporous Titanium Dioxide: Active Material in High-Performance Perovskite Solar Cells Nano Lett. 2014, 14, 127-133 10.1021/nl403514x
    • (2014) Nano Lett. , vol.14 , pp. 127-133
    • Choi, J.J.1    Yang, X.2    Norman, Z.M.3    Billinge, S.J.L.4    Owen, J.S.5
  • 54
    • 84904116436 scopus 로고    scopus 로고
    • Structural and Electronic Properties of Organo-Halide Lead Perovskites: A Combined IR-Spectroscopy and Ab Initio Molecular Dynamics Investigation
    • Mosconi, E.; Quarti, C.; Ivanovska, T.; Ruani, G.; De Angelis, F. Structural and Electronic Properties of Organo-Halide Lead Perovskites: A Combined IR-Spectroscopy and Ab Initio Molecular Dynamics Investigation Phys. Chem. Chem. Phys. 2014, 16, 16137-16144 10.1039/C4CP00569D
    • (2014) Phys. Chem. Chem. Phys. , vol.16 , pp. 16137-16144
    • Mosconi, E.1    Quarti, C.2    Ivanovska, T.3    Ruani, G.4    De Angelis, F.5
  • 55
    • 84928889754 scopus 로고    scopus 로고
    • 3 Perovskite from Ab Initio Molecular Dynamics Simulations
    • 3 Perovskite from Ab Initio Molecular Dynamics Simulations J. Phys. Chem. C 2015, 119, 8991-8997 10.1021/jp510568n
    • (2015) J. Phys. Chem. C , vol.119 , pp. 8991-8997
    • Carignano, M.A.1    Kachmar, A.2    Hutter, J.3
  • 56
    • 84905972936 scopus 로고    scopus 로고
    • Molecular Ferroelectric Contributions to Anomalous Hysteresis in Hybrid Perovskite Solar Cells
    • Frost, J. M.; Butler, K. T.; Walsh, A. Molecular Ferroelectric Contributions to Anomalous Hysteresis in Hybrid Perovskite Solar Cells APL Mater. 2014, 2, 081506 10.1063/1.4890246
    • (2014) APL Mater. , vol.2 , pp. 081506
    • Frost, J.M.1    Butler, K.T.2    Walsh, A.3
  • 57
    • 84900472666 scopus 로고    scopus 로고
    • Atomistic Origins of High-Performance in Hybrid Halide Perovskite Solar Cells
    • Frost, J. M.; Butler, K. T.; Brivio, F.; Hendon, C. H.; van Schilfgaarde, M.; Walsh, A. Atomistic Origins of High-Performance in Hybrid Halide Perovskite Solar Cells Nano Lett. 2014, 14, 2584-2590 10.1021/nl500390f
    • (2014) Nano Lett. , vol.14 , pp. 2584-2590
    • Frost, J.M.1    Butler, K.T.2    Brivio, F.3    Hendon, C.H.4    Van Schilfgaarde, M.5    Walsh, A.6
  • 59
    • 84949117641 scopus 로고    scopus 로고
    • Radiative Recombination and Photoconversion of Methylammonium Lead Iodide Perovskite by First Principles: Properties of an Inorganic Semiconductor Within a Hybrid Body
    • Filippetti, A.; Delugas, P.; Mattoni, A. Radiative Recombination and Photoconversion of Methylammonium Lead Iodide Perovskite by First Principles: Properties of an Inorganic Semiconductor Within a Hybrid Body J. Phys. Chem. C 2014, 118, 24843-24853 10.1021/jp507430x
    • (2014) J. Phys. Chem. C , vol.118 , pp. 24843-24853
    • Filippetti, A.1    Delugas, P.2    Mattoni, A.3
  • 60
    • 10644250257 scopus 로고
    • Inhomogeneous Electron Gas
    • Hohenberg, P.; Kohn, W. Inhomogeneous Electron Gas Phys. Rev. 1964, 136, B864 10.1103/PhysRev.136.B864
    • (1964) Phys. Rev. , vol.136 , pp. B864
    • Hohenberg, P.1    Kohn, W.2
  • 62
    • 0000696553 scopus 로고
    • Properties of Semiconductors with an Extremum Loop 1 Cyclotron and Combinational Resonance in a Magnetic Field Perpendicular to the Plane of the Loop
    • Rashba, E. I. Properties of Semiconductors with an Extremum Loop 1 Cyclotron and Combinational Resonance in a Magnetic Field Perpendicular to the Plane of the Loop Sov. Phys.-Solid State 1960, 2, 1109-1122
    • (1960) Sov. Phys. - Solid State , vol.2 , pp. 1109-1122
    • Rashba, E.I.1
  • 63
    • 4243343522 scopus 로고
    • Spin-Orbit Coupling Effects in Zinc Blende Structures
    • Dresselhaus, G. Spin-Orbit Coupling Effects in Zinc Blende Structures Phys. Rev. 1955, 100, 580-586 10.1103/PhysRev.100.580
    • (1955) Phys. Rev. , vol.100 , pp. 580-586
    • Dresselhaus, G.1
  • 64
    • 84899971975 scopus 로고    scopus 로고
    • Hidden Spin Polarization in Inversion-Symmetric Bulk Crystals
    • Zhang, X.; Liu, Q.; Luo, J.-W.; Freeman, A. J.; Zunger, A. Hidden Spin Polarization in Inversion-Symmetric Bulk Crystals Nat. Phys. 2014, 10, 387-393 10.1038/nphys2933
    • (2014) Nat. Phys. , vol.10 , pp. 387-393
    • Zhang, X.1    Liu, Q.2    Luo, J.-W.3    Freeman, A.J.4    Zunger, A.5
  • 65
    • 84900500424 scopus 로고    scopus 로고
    • Switchable S = 1/2 and J = 1/2 Rashba Bands in Ferroelectric Halide Perovskites
    • Kim, M.; Im, J.; Freeman, A. J.; Ihm, J.; Jin, H. Switchable S = 1/2 and J = 1/2 Rashba Bands in Ferroelectric Halide Perovskites Proc. Natl. Acad. Sci. U. S. A. 2014, 111, 6900-6904 10.1073/pnas.1405780111
    • (2014) Proc. Natl. Acad. Sci. U. S. A. , vol.111 , pp. 6900-6904
    • Kim, M.1    Im, J.2    Freeman, A.J.3    Ihm, J.4    Jin, H.5
  • 67
    • 36149016819 scopus 로고
    • New Method for Calculating the One-Particle Green's Function with Application to the Electron-Gas Problem
    • Hedin, L. New Method for Calculating the One-Particle Green's Function with Application to the Electron-Gas Problem Phys. Rev. 1965, 139, A796 10.1103/PhysRev.139.A796
    • (1965) Phys. Rev. , vol.139 , pp. A796
    • Hedin, L.1
  • 69
    • 33744818476 scopus 로고    scopus 로고
    • Quasiparticle Self-Consistent GW Theory
    • van Schilfgaarde, M.; Kotani, T.; Faleev, S. Quasiparticle Self-Consistent GW Theory Phys. Rev. Lett. 2006, 96, 226402 10.1103/PhysRevLett.96.226402
    • (2006) Phys. Rev. Lett. , vol.96 , pp. 226402
    • Van Schilfgaarde, M.1    Kotani, T.2    Faleev, S.3
  • 70
    • 4243690324 scopus 로고    scopus 로고
    • Maximally Localized Generalized Wannier Functions for Composite Energy Bands
    • Marzari, N.; Vanderbilt, D. Maximally Localized Generalized Wannier Functions for Composite Energy Bands Phys. Rev. B: Condens. Matter Mater. Phys. 1997, 56, 12847 10.1103/PhysRevB.56.12847
    • (1997) Phys. Rev. B: Condens. Matter Mater. Phys. , vol.56 , pp. 12847
    • Marzari, N.1    Vanderbilt, D.2
  • 72
    • 84922267214 scopus 로고    scopus 로고
    • Perovskites for Solar Thermoelectric Applications: A First Principle Study of CH3NH3AI3 (A = Pb and Sn)
    • He, Y.; Galli, G. Perovskites for Solar Thermoelectric Applications: A First Principle Study of CH3NH3AI3 (A = Pb and Sn) Chem. Mater. 2014, 26, 5394-5400 10.1021/cm5026766
    • (2014) Chem. Mater. , vol.26 , pp. 5394-5400
    • He, Y.1    Galli, G.2
  • 73
    • 84890921367 scopus 로고    scopus 로고
    • Small Photocarrier Effective Masses Featuring Ambipolar Transport in Methylammonium Lead Iodide Perovskite: A Density Functional Analysis
    • Giorgi, G.; Fujisawa, J.-I.; Segawa, H.; Yamashita, K. Small Photocarrier Effective Masses Featuring Ambipolar Transport in Methylammonium Lead Iodide Perovskite: A Density Functional Analysis J. Phys. Chem. Lett. 2013, 4, 4213-4216 10.1021/jz4023865
    • (2013) J. Phys. Chem. Lett. , vol.4 , pp. 4213-4216
    • Giorgi, G.1    Fujisawa, J.-I.2    Segawa, H.3    Yamashita, K.4
  • 74
    • 84898075059 scopus 로고    scopus 로고
    • Crystal Structures, Optical Properties, and Effective Mass Tensors of CH3NH3PbX3 (X = I and Br) Phases Predicted from HSE06
    • Feng, J.; Xiao, B. Crystal Structures, Optical Properties, and Effective Mass Tensors of CH3NH3PbX3 (X = I and Br) Phases Predicted from HSE06 J. Phys. Chem. Lett. 2014, 5, 1278-1282 10.1021/jz500480m
    • (2014) J. Phys. Chem. Lett. , vol.5 , pp. 1278-1282
    • Feng, J.1    Xiao, B.2
  • 75
    • 25544479230 scopus 로고
    • Electron Correlation in Semiconductors and Insulators: Band Gaps and Quasiparticle Energies
    • Hybertsen, M. S.; Louie, S. G. Electron Correlation in Semiconductors and Insulators: Band Gaps and Quasiparticle Energies Phys. Rev. B: Condens. Matter Mater. Phys. 1986, 34, 5390 10.1103/PhysRevB.34.5390
    • (1986) Phys. Rev. B: Condens. Matter Mater. Phys. , vol.34 , pp. 5390
    • Hybertsen, M.S.1    Louie, S.G.2
  • 76
    • 0036057017 scopus 로고    scopus 로고
    • Electronic Excitations: Density-Functional Versus Many-Body Green's Function Approaches
    • Onida, G.; Reining, L.; Rubio, A. Electronic Excitations: Density-Functional Versus Many-Body Green's Function Approaches Rev. Mod. Phys. 2002, 74, 601-659 10.1103/RevModPhys.74.601
    • (2002) Rev. Mod. Phys. , vol.74 , pp. 601-659
    • Onida, G.1    Reining, L.2    Rubio, A.3
  • 79
    • 0012050648 scopus 로고    scopus 로고
    • Quasiparticle Calculations in Solids
    • Aulbur, W. G.; Jönsson, L.; Wilkins, J. W. Quasiparticle Calculations in Solids Solid State Phys. 1999, 54, 1-218 10.1016/S0081-1947(08)60248-9
    • (1999) Solid State Phys. , vol.54 , pp. 1-218
    • Aulbur, W.G.1    Jönsson, L.2    Wilkins, J.W.3
  • 80
    • 33744691386 scopus 로고
    • Ground State of the Electron Gas by a Stochastic Method
    • Ceperley, D. M.; Alder, B. J. Ground State of the Electron Gas by a Stochastic Method Phys. Rev. Lett. 1980, 45, 566 10.1103/PhysRevLett.45.566
    • (1980) Phys. Rev. Lett. , vol.45 , pp. 566
    • Ceperley, D.M.1    Alder, B.J.2
  • 81
    • 36149012924 scopus 로고
    • Quantum Theory of the Dielectric Constant in Real Solids
    • Adler, S. L. Quantum Theory of the Dielectric Constant in Real Solids Phys. Rev. 1962, 126, 413-420 10.1103/PhysRev.126.413
    • (1962) Phys. Rev. , vol.126 , pp. 413-420
    • Adler, S.L.1
  • 82
    • 0009500590 scopus 로고
    • Metal-Insulator Transition in Kohn-Sham Theory and Quasiparticle Theory
    • Godby, R. W.; Needs, R. J. Metal-Insulator Transition in Kohn-Sham Theory and Quasiparticle Theory Phys. Rev. Lett. 1989, 62, 1169 10.1103/PhysRevLett.62.1169
    • (1989) Phys. Rev. Lett. , vol.62 , pp. 1169
    • Godby, R.W.1    Needs, R.J.2
  • 87
    • 76149109737 scopus 로고    scopus 로고
    • Estimating the Maximum Attainable Efficiency in Dye-Sensitized Solar Cells
    • Snaith, H. J. Estimating the Maximum Attainable Efficiency in Dye-Sensitized Solar Cells Adv. Funct. Mater. 2010, 20, 13-19 10.1002/adfm.200901476
    • (2010) Adv. Funct. Mater. , vol.20 , pp. 13-19
    • Snaith, H.J.1
  • 88
    • 34548180960 scopus 로고
    • Detailed Balance Limit of Efficiency of p-n Junction Solar Cells
    • Shockley, W.; Queisser, H. J. Detailed Balance Limit of Efficiency of p-n Junction Solar Cells J. Appl. Phys. 1961, 32, 510 10.1063/1.1736034
    • (1961) J. Appl. Phys. , vol.32 , pp. 510
    • Shockley, W.1    Queisser, H.J.2
  • 92
    • 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: Condens. Matter Mater. Phys. 1990, 41, 7892 10.1103/PhysRevB.41.7892
    • (1990) Phys. Rev. B: Condens. Matter Mater. Phys. , vol.41 , pp. 7892
    • Vanderbilt, D.1
  • 93
    • 0000549623 scopus 로고
    • Nonlinear Ionic Pseudopotentials in Spin-Density-Functional Calculations
    • Louie, S. G.; Froyen, S.; Cohen, M. L. Nonlinear Ionic Pseudopotentials in Spin-Density-Functional Calculations Phys. Rev. B: Condens. Matter Mater. Phys. 1982, 26, 1738 10.1103/PhysRevB.26.1738
    • (1982) Phys. Rev. B: Condens. Matter Mater. Phys. , vol.26 , pp. 1738
    • Louie, S.G.1    Froyen, S.2    Cohen, M.L.3
  • 95
    • 41149126038 scopus 로고    scopus 로고
    • Generalized Hedin's Equations for Quantum Many-Body Systems with Spin-Dependent Interactions
    • Aryasetiawan, F.; Biermann, S. Generalized Hedin's Equations for Quantum Many-Body Systems with Spin-Dependent Interactions Phys. Rev. Lett. 2008, 100, 116402 10.1103/PhysRevLett.100.116402
    • (2008) Phys. Rev. Lett. , vol.100 , pp. 116402
    • Aryasetiawan, F.1    Biermann, S.2
  • 96
    • 63749091822 scopus 로고    scopus 로고
    • Generalized Hedin Equations and σGσW Approximation for Quantum Many-Body Systems with Spin-Dependent Interactions
    • Aryasetiawan, F.; Biermann, S. Generalized Hedin Equations and σGσW Approximation for Quantum Many-Body Systems with Spin-Dependent Interactions J. Phys.: Condens. Matter 2009, 21, 064232 10.1088/0953-8984/21/6/064232
    • (2009) J. Phys.: Condens. Matter , vol.21 , pp. 064232
    • Aryasetiawan, F.1    Biermann, S.2
  • 98
    • 67650964169 scopus 로고    scopus 로고
    • Yambo: An Ab Initio Tool for Excited State Calculations
    • Marini, A.; Hogan, C.; Grüning, M.; Varsano, D. Yambo: An Ab Initio Tool for Excited State Calculations Comput. Phys. Commun. 2009, 180, 1392-1403 10.1016/j.cpc.2009.02.003
    • (2009) Comput. Phys. Commun. , vol.180 , pp. 1392-1403
    • Marini, A.1    Hogan, C.2    Grüning, M.3    Varsano, D.4
  • 99
    • 0037048416 scopus 로고    scopus 로고
    • First-Principles Approach to Insulators in Finite Electric Fields
    • Souza, I.; Iniguez, J.; Vanderbilt, D. First-Principles Approach to Insulators in Finite Electric Fields Phys. Rev. Lett. 2002, 89, 117602 10.1103/PhysRevLett.89.117602
    • (2002) Phys. Rev. Lett. , vol.89 , pp. 117602
    • Souza, I.1    Iniguez, J.2    Vanderbilt, D.3
  • 100
    • 0037037908 scopus 로고    scopus 로고
    • Ab Initio Molecular Dynamics in a Finite Homogeneous Electric Field
    • Umari, P.; Pasquarello, A. Ab Initio Molecular Dynamics in a Finite Homogeneous Electric Field Phys. Rev. Lett. 2002, 89, 157602 10.1103/PhysRevLett.89.157602
    • (2002) Phys. Rev. Lett. , vol.89 , pp. 157602
    • Umari, P.1    Pasquarello, A.2
  • 101
    • 78650491412 scopus 로고    scopus 로고
    • Electron-Phonon Renormalization of the Direct Band Gap of Diamond
    • Giustino, F.; Louie, S. G.; Cohen, M. L. Electron-Phonon Renormalization of the Direct Band Gap of Diamond Phys. Rev. Lett. 2010, 105, 265501 10.1103/PhysRevLett.105.265501
    • (2010) Phys. Rev. Lett. , vol.105 , pp. 265501
    • Giustino, F.1    Louie, S.G.2    Cohen, M.L.3
  • 102
    • 84938248104 scopus 로고    scopus 로고
    • Temperature Dependence of the Electronic Structure of Semiconductor and Insulators
    • Poncé, S.; Gillet, Y.; Janssen, J. L.; Marini, A.; Verstraete, M.; Gonze, X. Temperature Dependence of the Electronic Structure of Semiconductor and Insulators J. Chem. Phys. 2015, 143, 102813 10.1063/1.4927081
    • (2015) J. Chem. Phys. , vol.143 , pp. 102813
    • Poncé, S.1    Gillet, Y.2    Janssen, J.L.3    Marini, A.4    Verstraete, M.5    Gonze, X.6
  • 104
    • 84955493935 scopus 로고    scopus 로고
    • University of Oxford Advanced Research Computing
    • Richards, A. University of Oxford Advanced Research Computing. http://dx.doi.org/10.5281/zenodo.22558, 2015.
    • (2015)
    • Richards, A.1
  • 105
    • 43749120253 scopus 로고    scopus 로고
    • VESTA: A Three-Dimensional Visualization System for Electronic and Structural Analysis
    • Momma, K.; Izumi, F. VESTA: A Three-Dimensional Visualization System for Electronic and Structural Analysis J. Appl. Crystallogr. 2008, 41, 653 10.1107/S0021889808012016
    • (2008) J. Appl. Crystallogr. , vol.41 , pp. 653
    • Momma, K.1    Izumi, F.2


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.