-
1
-
-
84868195671
-
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
-
2
-
-
84887735046
-
Perovskites: The Emergence of a New Era for Low-Cost, High-Efficiency Solar Cells
-
Snaith, H. J. Perovskites: The Emergence of a New Era for Low-Cost, High-Efficiency Solar Cells. J. Phys. Chem. Lett. 2013, 4, 3623-3630, 10.1021/jz4020162
-
(2013)
J. Phys. Chem. Lett.
, vol.4
, pp. 3623-3630
-
-
Snaith, H.J.1
-
3
-
-
84924120572
-
Halide perovskite materials for solar cells: A theoretical review
-
Yin, W.-J.; Yang, J.-H.; Kang, J.; Yan, Y.; Wei, S.-H. Halide perovskite materials for solar cells: a theoretical review. J. Mater. Chem. A 2015, 3, 8926-8942, 10.1039/C4TA05033A
-
(2015)
J. Mater. Chem. A
, vol.3
, pp. 8926-8942
-
-
Yin, W.-J.1
Yang, J.-H.2
Kang, J.3
Yan, Y.4
Wei, S.-H.5
-
4
-
-
84959462771
-
A mixed-cation lead mixed-halide perovskite absorber for tandem solar cells
-
McMeekin, D. P.; Sadoughi, G.; Rehman, W.; Eperon, G. E.; Saliba, M.; Horantner, M. T.; Haghighirad, A.; Sakai, N.; Korte, L.; Rech, B.; Johnston, M. B.; Herz, L. M.; Snaith, H. J. A mixed-cation lead mixed-halide perovskite absorber for tandem solar cells. Science 2016, 351, 151-155, 10.1126/science.aad5845
-
(2016)
Science
, vol.351
, pp. 151-155
-
-
McMeekin, D.P.1
Sadoughi, G.2
Rehman, W.3
Eperon, G.E.4
Saliba, M.5
Horantner, M.T.6
Haghighirad, A.7
Sakai, N.8
Korte, L.9
Rech, B.10
Johnston, M.B.11
Herz, L.M.12
Snaith, H.J.13
-
5
-
-
84992110481
-
Perovskite-perovskite tandem photovoltaics with optimized band gaps
-
Eperon, G. E.; Leijtens, T.; Bush, K. A.; Prasanna, R.; Green, T.; Wang, J. T.-W.; McMeekin, D. P.; Volonakis, G.; Milot, R. L.; May, R.; Palmstrom, A.; Slotcavage, D. J.; Belisle, R. A.; Patel, J. B.; Parrott, E. S.; Sutton, R. J.; Ma, W.; Moghadam, F.; Conings, B.; Babayigit, A.; Boyen, H.-G.; Bent, S.; Giustino, F.; Herz, L. M.; Johnston, M. B.; McGehee, M. D.; Snaith, H. J. Perovskite-perovskite tandem photovoltaics with optimized band gaps. Science 2016, 354, 861-865, 10.1126/science.aaf9717
-
(2016)
Science
, vol.354
, pp. 861-865
-
-
Eperon, G.E.1
Leijtens, T.2
Bush, K.A.3
Prasanna, R.4
Green, T.5
Wang, J.T.-W.6
McMeekin, D.P.7
Volonakis, G.8
Milot, R.L.9
May, R.10
Palmstrom, A.11
Slotcavage, D.J.12
Belisle, R.A.13
Patel, J.B.14
Parrott, E.S.15
Sutton, R.J.16
Ma, W.17
Moghadam, F.18
Conings, B.19
Babayigit, A.20
Boyen, H.-G.21
Bent, S.22
Giustino, F.23
Herz, L.M.24
Johnston, M.B.25
McGehee, M.D.26
Snaith, H.J.27
more..
-
6
-
-
85016324194
-
Low-bandgap mixed tin-lead iodide perovskite absorbers with long carrier lifetimes for all-perovskite tandem solar cells
-
Zhao, D.; Yu, Y.; Wang, C.; Liao, W.; Shrestha, N.; Grice, C. R.; Cimaroli, A. J.; Guan, L.; Ellingson, R. y. J.; Zhu, K.; Zhao, X.; Xiong, R.-G.; Yan, Y. Low-bandgap mixed tin-lead iodide perovskite absorbers with long carrier lifetimes for all-perovskite tandem solar cells. Nat. Energy 2017, 2, 17018, 10.1038/nenergy.2017.18
-
(2017)
Nat. Energy
, vol.2
, pp. 17018
-
-
Zhao, D.1
Yu, Y.2
Wang, C.3
Liao, W.4
Shrestha, N.5
Grice, C.R.6
Cimaroli, A.J.7
Guan, L.8
Ellingson, Y.R.J.9
Zhu, K.10
Zhao, X.11
Xiong, R.-G.12
Yan, Y.13
-
7
-
-
33748466741
-
Efficiency limits for single-junction and tandem solar cells
-
Meillaud, F.; Shah, A.; Droz, C.; Vallat-Sauvain, E.; Miazza, C. Efficiency limits for single-junction and tandem solar cells. Sol. Energy Mater. Sol. Cells 2006, 90, 2952-2959, 10.1016/j.solmat.2006.06.002
-
(2006)
Sol. Energy Mater. Sol. Cells
, vol.90
, pp. 2952-2959
-
-
Meillaud, F.1
Shah, A.2
Droz, C.3
Vallat-Sauvain, E.4
Miazza, C.5
-
8
-
-
84983661482
-
50% Sn-Based Planar Perovskite Solar Cell with Power Conversion Efficiency up to 13.6%
-
Li, Y.; Sun, W.; Yan, W.; Ye, S.; Rao, H.; Peng, H.; Zhao, Z.; Bian, Z.; Liu, Z.; Zhou, H.; Huang, C. 50% Sn-Based Planar Perovskite Solar Cell with Power Conversion Efficiency up to 13.6%. Adv. Energy Mater. 2016, 6, 1601353, 10.1002/aenm.201601353
-
(2016)
Adv. Energy Mater.
, vol.6
, pp. 1601353
-
-
Li, Y.1
Sun, W.2
Yan, W.3
Ye, S.4
Rao, H.5
Peng, H.6
Zhao, Z.7
Bian, Z.8
Liu, Z.9
Zhou, H.10
Huang, C.11
-
9
-
-
85041829799
-
Four-Terminal All-Perovskite Tandem Solar Cells Achieving Power Conversion Efficiencies Exceeding 23%
-
Zhao, D.; Wang, C.; Song, Z.; Yu, Y.; Chen, C.; Zhao, X.; Zhu, K.; Yan, Y. Four-Terminal All-Perovskite Tandem Solar Cells Achieving Power Conversion Efficiencies Exceeding 23%. ACS Energy Letters 2018, 3, 305-306, 10.1021/acsenergylett.7b01287
-
(2018)
ACS Energy Letters
, vol.3
, pp. 305-306
-
-
Zhao, D.1
Wang, C.2
Song, Z.3
Yu, Y.4
Chen, C.5
Zhao, X.6
Zhu, K.7
Yan, Y.8
-
10
-
-
84941106552
-
Binary-Metal Perovskites Toward High-Performance Planar-Heterojunction Hybrid Solar Cells
-
Zuo, F.; Williams, S. T.; Liang, P.-W.; Chueh, C.-C.; Liao, C.-Y.; Jen, A. K.-Y. Binary-Metal Perovskites Toward High-Performance Planar-Heterojunction Hybrid Solar Cells. Adv. Mater. 2014, 26, 6454-6460, 10.1002/adma.201401641
-
(2014)
Adv. Mater.
, vol.26
, pp. 6454-6460
-
-
Zuo, F.1
Williams, S.T.2
Liang, P.-W.3
Chueh, C.-C.4
Liao, C.-Y.5
Jen, A.K.-Y.6
-
11
-
-
84901937010
-
Anomalous Band Gap Behavior in Mixed Sn and Pb Perovskites Enables Broadening of Absorption 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 Absorption 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
-
12
-
-
84897887918
-
3 Perovskite Solar Cells Covering up to 1060 nm
-
3 Perovskite Solar Cells Covering up to 1060 nm. J. Phys. Chem. Lett. 2014, 5, 1004-1011, 10.1021/jz5002117
-
(2014)
J. Phys. Chem. Lett.
, vol.5
, pp. 1004-1011
-
-
Ogomi, Y.1
Morita, A.2
Tsukamoto, S.3
Saitho, T.4
Fujikawa, N.5
Shen, Q.6
Toyoda, T.7
Yoshino, K.8
Pandey, S.S.9
Ma, T.10
Hayase, S.11
-
13
-
-
84940910858
-
3
-
3. J. Phys. Chem. Lett. 2015, 6, 3503-3509, 10.1021/acs.jpclett.5b01738
-
(2015)
J. Phys. Chem. Lett.
, vol.6
, pp. 3503-3509
-
-
Im, J.1
Stoumpos, C.C.2
Jin, H.3
Freeman, A.J.4
Kanatzidis, M.G.5
-
14
-
-
84979284429
-
3 absorbers: A roadmap for perovskite-on-perovskite tandem solar cells
-
3 absorbers: a roadmap for perovskite-on-perovskite tandem solar cells. J. Mater. Chem. A 2016, 4, 11214-11221, 10.1039/C6TA04840D
-
(2016)
J. Mater. Chem. A
, vol.4
, pp. 11214-11221
-
-
Anaya, M.1
Correa-Baena, J.P.2
Lozano, G.3
Saliba, M.4
Anguita, P.5
Roose, B.6
Abate, A.7
Steiner, U.8
Grätzel, M.9
Calvo, M.E.10
Hagfeldt, A.11
Míguez, H.12
-
15
-
-
33744818476
-
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
-
16
-
-
0000214080
-
Special quasirandom structures
-
Zunger, A.; Wei, S.-H.; Ferreira, L. G.; Bernard, J. E. Special quasirandom structures. Phys. Rev. Lett. 1990, 65, 353-356, 10.1103/PhysRevLett.65.353
-
(1990)
Phys. Rev. Lett.
, vol.65
, pp. 353-356
-
-
Zunger, A.1
Wei, S.-H.2
Ferreira, L.G.3
Bernard, J.E.4
-
18
-
-
33845480101
-
Band-gap bowing coefficients in large size-mismatched II-VI alloys: First-principles calculations
-
Moon, C.-Y.; Wei, S.-H.; Zhu, Y. Z.; Chen, G. D. Band-gap bowing coefficients in large size-mismatched II-VI alloys: first-principles calculations. Phys. Rev. B: Condens. Matter Mater. Phys. 2006, 74, 233202, 10.1103/PhysRevB.74.233202
-
(2006)
Phys. Rev. B: Condens. Matter Mater. Phys.
, vol.74
, pp. 233202
-
-
Moon, C.-Y.1
Wei, S.-H.2
Zhu, Y.Z.3
Chen, G.D.4
-
19
-
-
84906911172
-
Bandgap calculations and trends of organometal halide perovskites
-
Castelli, I. E.; García-Lastra, J. M.; Thygesen, K. S.; Jacobsen, K. W. Bandgap calculations and trends of organometal halide perovskites. APL Mater. 2014, 2, 081514, 10.1063/1.4893495
-
(2014)
APL Mater.
, vol.2
, pp. 081514
-
-
Castelli, I.E.1
García-Lastra, J.M.2
Thygesen, K.S.3
Jacobsen, K.W.4
-
20
-
-
33644641832
-
Ab Initio Prediction of Conduction Band Spin Splitting in Zinc Blende Semiconductors
-
Chantis, A. N.; van Schilfgaarde, M.; Kotani, T. Ab Initio Prediction of Conduction Band Spin Splitting in Zinc Blende Semiconductors. Phys. Rev. Lett. 2006, 96, 086405, 10.1103/PhysRevLett.96.086405
-
(2006)
Phys. Rev. Lett.
, vol.96
, pp. 086405
-
-
Chantis, A.N.1
Van Schilfgaarde, M.2
Kotani, T.3
-
21
-
-
84964933220
-
Accurate energy bands calculated by the hybrid quasiparticle self-consistent GW method implemented in the ecalj package
-
Deguchi, D.; Sato, K.; Kino, H.; Kotani, T. Accurate energy bands calculated by the hybrid quasiparticle self-consistent GW method implemented in the ecalj package. Jpn. J. Appl. Phys. 2016, 55, 051201, 10.7567/JJAP.55.051201
-
(2016)
Jpn. J. Appl. Phys.
, vol.55
, pp. 051201
-
-
Deguchi, D.1
Sato, K.2
Kino, H.3
Kotani, T.4
-
22
-
-
84881184996
-
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
-
23
-
-
85033727783
-
Mechanism of Oxidation and Stabilization by Lead Substitution in Halide Perovskites
-
Leijtens, T.; Prasanna, R.; Gold-Parker, A.; Toney, M. F.; McGehee, M. D. Mechanism of Oxidation and Stabilization by Lead Substitution in Halide Perovskites. ACS Energy Lett. 2017, 2, 2159-2165, 10.1021/acsenergylett.7b00636
-
(2017)
ACS Energy Lett.
, vol.2
, pp. 2159-2165
-
-
Leijtens, T.1
Prasanna, R.2
Gold-Parker, A.3
Toney, M.F.4
McGehee, M.D.5
-
25
-
-
84899727290
-
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
-
26
-
-
84925282605
-
Band alignment of the hybrid halide perovskites CH 3 NH 3 PbCl 3, CH 3 NH 3 PbBr 3 and CH 3 NH 3 PbI 3
-
Butler, K. T.; Frost, J. M.; Walsh, A. Band alignment of the hybrid halide perovskites CH 3 NH 3 PbCl 3, CH 3 NH 3 PbBr 3 and CH 3 NH 3 PbI 3. Mater. Horiz. 2015, 2, 228-231, 10.1039/C4MH00174E
-
(2015)
Mater. Horiz.
, vol.2
, pp. 228-231
-
-
Butler, K.T.1
Frost, J.M.2
Walsh, A.3
-
27
-
-
85006994928
-
Stable α/δ phase junction of formamidinium lead iodide perovskites for enhanced near-infrared emission
-
Ma, F.; Li, J.; Li, W.; Lin, N.; Wang, L.; Qiao, J. Stable α/ δ phase junction of formamidinium lead iodide perovskites for enhanced near-infrared emission. Chemical Science 2017, 8, 800-805, 10.1039/C6SC03542F
-
(2017)
Chemical Science
, vol.8
, pp. 800-805
-
-
Ma, F.1
Li, J.2
Li, W.3
Lin, N.4
Wang, L.5
Qiao, J.6
-
28
-
-
84900472666
-
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
-
29
-
-
85027416243
-
Band Gap Tuning via Lattice Contraction and Octahedral Tilting in Perovskite Materials for Photovoltaics
-
Prasanna, R.; Gold-Parker, A.; Leijtens, T.; Conings, B.; Babayigit, A.; Boyen, H.-G.; Toney, M. F.; McGehee, M. D. Band Gap Tuning via Lattice Contraction and Octahedral Tilting in Perovskite Materials for Photovoltaics. J. Am. Chem. Soc. 2017, 139, 11117-11124, 10.1021/jacs.7b04981
-
(2017)
J. Am. Chem. Soc.
, vol.139
, pp. 11117-11124
-
-
Prasanna, R.1
Gold-Parker, A.2
Leijtens, T.3
Conings, B.4
Babayigit, A.5
Boyen, H.-G.6
Toney, M.F.7
McGehee, M.D.8
-
30
-
-
84923350347
-
Steric engineering of metal-halide perovskites with tunable optical band gaps
-
Filip, M. R.; Eperon, G. E.; 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.E.2
Snaith, H.J.3
Giustino, F.4
-
31
-
-
84992225378
-
Valence and conduction band tuning in halide perovskites for solar cell applications
-
Meloni, S.; Palermo, G.; Ashari-Astani, N.; Grätzel, M.; Rothlisberger, U. Valence and conduction band tuning in halide perovskites for solar cell applications. J. Mater. Chem. A 2016, 4, 15997-16002, 10.1039/C6TA04949D
-
(2016)
J. Mater. Chem. A
, vol.4
, pp. 15997-16002
-
-
Meloni, S.1
Palermo, G.2
Ashari-Astani, N.3
Grätzel, M.4
Rothlisberger, U.5
-
32
-
-
84945928575
-
The Renaissance of Halide Perovskites and Their Evolution as Emerging Semiconductors
-
Stoumpos, C. C.; Kanatzidis, M. G. The Renaissance of Halide Perovskites and Their Evolution as Emerging Semiconductors. Acc. Chem. Res. 2015, 48, 2791-2802, 10.1021/acs.accounts.5b00229
-
(2015)
Acc. Chem. Res.
, vol.48
, pp. 2791-2802
-
-
Stoumpos, C.C.1
Kanatzidis, M.G.2
-
33
-
-
85017530444
-
Influence of Rb/Cs Cation-Exchange on Inorganic Sn Halide Perovskites: From Chemical Structure to Physical Properties
-
Jung, Y.-K.; Lee, J.-H.; Walsh, A.; Soon, A. Influence of Rb/Cs Cation-Exchange on Inorganic Sn Halide Perovskites: From Chemical Structure to Physical Properties. Chem. Mater. 2017, 29, 3181-3188, 10.1021/acs.chemmater.7b00260
-
(2017)
Chem. Mater.
, vol.29
, pp. 3181-3188
-
-
Jung, Y.-K.1
Lee, J.-H.2
Walsh, A.3
Soon, A.4
-
34
-
-
84876029268
-
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
-
35
-
-
84949116649
-
x) Solar Cells
-
x) Solar Cells. J. Phys. Chem. C 2015, 119, 1763-1767, 10.1021/jp5126624
-
(2015)
J. Phys. Chem. C
, vol.119
, pp. 1763-1767
-
-
Sabba, D.1
Mulmudi, H.K.2
Prabhakar, R.R.3
Krishnamoorthy, T.4
Baikie, T.5
Boix, P.P.6
Mhaisalkar, S.7
Mathews, N.8
-
36
-
-
0036945029
-
The alloy theoretic automated toolkit: A user guide
-
van de Walle, A.; Asta, M.; Ceder, G. The alloy theoretic automated toolkit: A user guide. CALPHAD: Comput. Coupling Phase Diagrams Thermochem. 2002, 26, 539-553, 10.1016/S0364-5916(02)80006-2
-
(2002)
CALPHAD: Comput. Coupling Phase Diagrams Thermochem.
, vol.26
, pp. 539-553
-
-
Van De Walle, A.1
Asta, M.2
Ceder, G.3
-
37
-
-
84881182494
-
Efficient stochastic generation of special quasirandom structures
-
van de Walle, A.; Tiwary, P.; de Jong, M.; Olmsted, D.; Asta, M.; Dick, A.; Shin, D.; Wang, Y.; Chen, L.-Q.; Liu, Z.-K. Efficient stochastic generation of special quasirandom structures. CALPHAD: Comput. Coupling Phase Diagrams Thermochem. 2013, 42, 13-18, 10.1016/j.calphad.2013.06.006
-
(2013)
CALPHAD: Comput. Coupling Phase Diagrams Thermochem.
, vol.42
, pp. 13-18
-
-
Van De Walle, A.1
Tiwary, P.2
De Jong, M.3
Olmsted, D.4
Asta, M.5
Dick, A.6
Shin, D.7
Wang, Y.8
Chen, L.-Q.9
Liu, Z.-K.10
-
39
-
-
0030190741
-
Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set
-
Kresse, G.; Furthmüller, J. Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set. Comput. Mater. Sci. 1996, 6, 15-50, 10.1016/0927-0256(96)00008-0
-
(1996)
Comput. Mater. Sci.
, vol.6
, pp. 15-50
-
-
Kresse, G.1
Furthmüller, J.2
-
40
-
-
4243943295
-
Generalized Gradient Approximation Made Simple
-
Perdew, J. P.; Burke, K.; Ernzerhof, M. Generalized Gradient Approximation Made Simple. Phys. Rev. Lett. 1996, 77, 3865-3868, 10.1103/PhysRevLett.77.3865
-
(1996)
Phys. Rev. Lett.
, vol.77
, pp. 3865-3868
-
-
Perdew, J.P.1
Burke, K.2
Ernzerhof, M.3
-
41
-
-
0037799714
-
Hybrid functionals based on a screened Coulomb potential
-
Heyd, J.; Scuseria, G. E.; Ernzerhof, M. Hybrid functionals based on a screened Coulomb potential. J. Chem. Phys. 2003, 118, 8207-8215, 10.1063/1.1564060
-
(2003)
J. Chem. Phys.
, vol.118
, pp. 8207-8215
-
-
Heyd, J.1
Scuseria, G.E.2
Ernzerhof, M.3
-
42
-
-
34547139312
-
Erratum: "hybrid functionals based on a screened Coulomb potential" [J. Chem. Phys. 118, 8207 (2003)]
-
Heyd, J.; Scuseria, G. E.; Ernzerhof, M. Erratum: "Hybrid functionals based on a screened Coulomb potential" [J. Chem. Phys. 118, 8207 (2003)]. J. Chem. Phys. 2006, 124, 219906, 10.1063/1.2204597
-
(2006)
J. Chem. Phys.
, vol.124
, pp. 219906
-
-
Heyd, J.1
Scuseria, G.E.2
Ernzerhof, M.3
-
43
-
-
1842816907
-
Special points for Brillouin-zone integrations
-
Monkhorst, H. J.; Pack, J. D. Special points for Brillouin-zone integrations. Phys. Rev. B 1976, 13, 5188-5192, 10.1103/PhysRevB.13.5188
-
(1976)
Phys. Rev. B
, vol.13
, pp. 5188-5192
-
-
Monkhorst, H.J.1
Pack, J.D.2
-
44
-
-
35148875518
-
Quasiparticle self-consistent GW method: A basis for the independent-particle approximation
-
Kotani, T.; van Schilfgaarde, M.; Faleev, S. V. Quasiparticle self-consistent GW method: A basis for the independent-particle approximation. Phys. Rev. B: Condens. Matter Mater. Phys. 2007, 76, 165106, 10.1103/PhysRevB.76.165106
-
(2007)
Phys. Rev. B: Condens. Matter Mater. Phys.
, vol.76
, pp. 165106
-
-
Kotani, T.1
Van Schilfgaarde, M.2
Faleev, S.V.3
-
46
-
-
33846386880
-
Adequacy of approximations in GW theory
-
van Schilfgaarde, M.; Kotani, T.; Faleev, S. V. Adequacy of approximations in GW theory. Phys. Rev. B: Condens. Matter Mater. Phys. 2006, 74, 245125, 10.1103/PhysRevB.74.245125
-
(2006)
Phys. Rev. B: Condens. Matter Mater. Phys.
, vol.74
, pp. 245125
-
-
Van Schilfgaarde, M.1
Kotani, T.2
Faleev, S.V.3
-
47
-
-
0642361352
-
Fully relativistic treatment of core states for spin-dependent potential
-
Ebert, H. Fully relativistic treatment of core states for spin-dependent potential. J. Phys.: Condens. Matter 1989, 1, 9111, 10.1088/0953-8984/1/46/005
-
(1989)
J. Phys.: Condens. Matter
, vol.1
, pp. 9111
-
-
Ebert, H.1
-
48
-
-
33846384374
-
Exchange and Correlation Effects in Electronic Excitations of Cu2O
-
Bruneval, F.; Vast, N.; Reining, L.; Izquierdo, M.; Sirotti, F.; Barrett, N. Exchange and Correlation Effects in Electronic Excitations of Cu2O. Phys. Rev. Lett. 2006, 97, 267601, 10.1103/PhysRevLett.97.267601
-
(2006)
Phys. Rev. Lett.
, vol.97
, pp. 267601
-
-
Bruneval, F.1
Vast, N.2
Reining, L.3
Izquierdo, M.4
Sirotti, F.5
Barrett, N.6
-
49
-
-
85044434810
-
Lattice polarization effects on the screened Coulomb interaction W of the GW approximation
-
Lambrecht, W. R. L.; Bhandari, C.; van Schilfgaarde, M. Lattice polarization effects on the screened Coulomb interaction W of the GW approximation. Phys. Rev. Mater. 2017, 1, 043802, 10.1103/PhysRevMaterials.1.043802
-
(2017)
Phys. Rev. Mater.
, vol.1
, pp. 043802
-
-
Lambrecht, W.R.L.1
Bhandari, C.2
Van Schilfgaarde, M.3
-
50
-
-
84931521983
-
Electrons in lattice fields
-
Fröhlich, H. Electrons in lattice fields. Adv. Phys. 1954, 3, 325-361, 10.1080/00018735400101213
-
(1954)
Adv. Phys.
, vol.3
, pp. 325-361
-
-
Fröhlich, H.1
-
51
-
-
57749196971
-
Assessment of correction methods for the band-gap problem and for finite-size effects in supercell defect calculations: Case studies for ZnO and GaAs
-
Lany, S.; Zunger, A. Assessment of correction methods for the band-gap problem and for finite-size effects in supercell defect calculations: Case studies for ZnO and GaAs. Phys. Rev. B: Condens. Matter Mater. Phys. 2008, 78, 235104, 10.1103/PhysRevB.78.235104
-
(2008)
Phys. Rev. B: Condens. Matter Mater. Phys.
, vol.78
, pp. 235104
-
-
Lany, S.1
Zunger, A.2
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