Ab initio description of the Bi2Sr2CaCu2O8+δ electronic structure

Nokelainen, Johannes; Lane, Christopher A.; Markiewicz, Robert S.; Barbiellini, Bernardo; Pulkkinen, Aki; Singh, Bahadur; Sun, Jianwei; Pussi, Katariina; Bansil, Arun

doi:10.1103/physrevb.101.214523

Ab initio description of the Bi₂Sr₂CaCu₂O_8+δ electronic structure

Journal Article · Fri Jun 26 00:00:00 EDT 2020 · Physical Review B

DOI:https://doi.org/10.1103/physrevb.101.214523· OSTI ID:1726191

^[1]; ^[2]; Markiewicz, Robert S. ^[3]; ^[4]; Pulkkinen, Aki ^[5]; Singh, Bahadur ^[3]; Sun, Jianwei ^[6]; Pussi, Katariina ^[1]; Bansil, Arun ^[7]

LUT Univ., Lappeenranta (Finland)
Los Alamos National Lab. (LANL), Los Alamos, NM (United States)
Northeastern Univ., Boston, MA (United States)
LUT Univ., Lappeenranta (Finland); Northeastern Univ., Boston, MA (United States)
LUT Univ., Lappeenranta (Finland); Univ. of Fribourg (Switzerland)
Tulane Univ., New Orleans, LA (United States)
Northeastern University (United States)

Bi-based cuprate superconductors are important materials for both fundamental research and applications. As in other cuprates, the superconducting phase in the Bi compounds lies close to an antiferromagnetic phase. Here, our density functional theory calculations based on the strongly-constrained-and-appropriately-normed exchange correlation functional in Bi₂Sr₂CaCu₂O_8+δ reveal the persistence of magnetic moments on the copper ions for oxygen concentrations ranging from the pristine phase to the optimally hole-doped compound. We also find the existence of ferrimagnetic solutions in the heavily doped compounds, which are expected to suppress superconductivity.

View Accepted Manuscript (DOE)

Research Organization:: Los Alamos National Laboratory (LANL), Los Alamos, NM (United States)

Sponsoring Organization:: USDOE National Nuclear Security Administration (NNSA); USDOE Office of Science (SC), Basic Energy Sciences (BES)

Grant/Contract Number:: 89233218CNA000001; AC02-05CH11231; FG02-07ER46352; SC0012432; SC0012575

OSTI ID:: 1726191

Report Number(s):: LA-UR--20-22220

Journal Information:: Physical Review B, Journal Name: Physical Review B Journal Issue: 21 Vol. 101; ISSN 2469-9950

Publisher:: American Physical Society (APS)Copyright Statement

Country of Publication:: United States

Language:: English

References (94)

Visualization of Dopant Oxygen Atoms in a Bi ₂ Sr ₂ CaCu ₂ O ₈₊ _δ Superconductor Song, Dongsheng; Zhang, Xuefeng; Lian, Chaosheng Advanced Functional Materials, Vol. 29, Issue 45 https://doi.org/10.1002/adfm.201903843	journal	September 2019
Possible highT c superconductivity in the Ba?La?Cu?O system Bednorz, J. G.; M�ller, K. A. Zeitschrift f�r Physik B Condensed Matter, Vol. 64, Issue 2 https://doi.org/10.1007/BF01303701	journal	June 1986
Structure, Superstructure and Charge Order in Bi-Cuprates Dudy, L.; Janowitz, C.; Lübben, O. Journal of Superconductivity and Novel Magnetism, Vol. 22, Issue 1 https://doi.org/10.1007/s10948-008-0360-x	journal	October 2008
The case for dx2 − y2 pairing in the cuprate superconductors Scalapino, D. J. Physics Reports, Vol. 250, Issue 6 https://doi.org/10.1016/0370-1573(94)00086-I	journal	January 1995
Electronic structure and properties of Bi2Sr2CaCu2O8, the third high-Tc superconductor Massidda, S.; Yu, Jaejun; Freeman, A. J. Physica C: Superconductivity, Vol. 152, Issue 3 https://doi.org/10.1016/0921-4534(88)90136-0	journal	May 1988
Gap distribution of the tunneling spectra in Bi2Sr2CaCu2Ox and some other superconductors Barbiellini, B.; Fischer, O.; Peter, M. Physica C: Superconductivity, Vol. 220, Issue 1-2 https://doi.org/10.1016/0921-4534(94)90883-4	journal	February 1994
Evidence of antiferromagnetic ordering of Cu2+ spins in non-superconducting Bi-2212 Moudden, A. H.; Vasiliu-Doloc, L.; Blanchard, N. Physica C: Superconductivity, Vol. 235-240 https://doi.org/10.1016/0921-4534(94)92036-2	journal	December 1994
Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set Kresse, G.; Furthmüller, J. Computational Materials Science, Vol. 6, Issue 1, p. 15-50 https://doi.org/10.1016/0927-0256(96)00008-0	journal	July 1996
Python Materials Genomics (pymatgen): A robust, open-source python library for materials analysis Ong, Shyue Ping; Richards, William Davidson; Jain, Anubhav Computational Materials Science, Vol. 68 https://doi.org/10.1016/j.commatsci.2012.10.028	journal	February 2013
PyProcar: A Python library for electronic structure pre/post-processing Herath, Uthpala; Tavadze, Pedram; He, Xu Computer Physics Communications, Vol. 251 https://doi.org/10.1016/j.cpc.2019.107080	journal	June 2020
Superconductivity, antiferromagnetism, and neutron scattering Tranquada, John M.; Xu, Guangyong; Zaliznyak, Igor A. Journal of Magnetism and Magnetic Materials, Vol. 350 https://doi.org/10.1016/j.jmmm.2013.09.029	journal	January 2014
Structural and electronic properties of Pb-doped Bi 2 Sr 2 Ca 2 Cu 3 O 10 : Comparison of LDA and GGA calculations Camargo-Martínez, J. A.; Martínez-Pieschacón, D. J.; Baquero, R. Physica C: Superconductivity and its Applications, Vol. 535 https://doi.org/10.1016/j.physc.2017.03.004	journal	April 2017
What controls the critical temperature of high temperature copper oxide superconductors: insights from scanneling tunnelling microscopy Weber, Cedric Science Bulletin, Vol. 62, Issue 2 https://doi.org/10.1016/j.scib.2016.12.007	journal	January 2017
Nanoscale Interplay of Strain and Doping in a High-Temperature Superconductor Zeljkovic, Ilija; Nieminen, Jouko; Huang, Dennis Nano Letters, Vol. 14, Issue 12 https://doi.org/10.1021/nl501890k	journal	November 2014
Imaging the granular structure of high-Tc superconductivity in underdoped Bi2Sr2CaCu2O8+δ Lang, K. M.; Madhavan, V.; Hoffman, J. E. Nature, Vol. 415, Issue 6870 https://doi.org/10.1038/415412a	journal	January 2002
Relating atomic-scale electronic phenomena to wave-like quasiparticle states in superconducting Bi2Sr2CaCu2O8+δ McElroy, K.; Simmonds, R. W.; Hoffman, J. E. Nature, Vol. 422, Issue 6932 https://doi.org/10.1038/nature01496	journal	April 2003
Accurate first-principles structures and energies of diversely bonded systems from an efficient density functional Sun, Jianwei; Remsing, Richard C.; Zhang, Yubo Nature Chemistry, Vol. 8, Issue 9 https://doi.org/10.1038/nchem.2535	journal	June 2016
Fixing Jacob's ladder Car, Roberto Nature Chemistry, Vol. 8, Issue 9 https://doi.org/10.1038/nchem.2605	journal	August 2016
Anisotropic softening of magnetic excitations along the nodal direction in superconducting cuprates Guarise, M.; Piazza, B. Dalla; Berger, H. Nature Communications, Vol. 5, Issue 1 https://doi.org/10.1038/ncomms6760	journal	December 2014
Scanning tunnelling microscopy imaging of symmetry-breaking structural distortion in the bismuth-based cuprate superconductors Zeljkovic, Ilija; Main, Elizabeth J.; Williams, Tess L. Nature Materials, Vol. 11, Issue 7 https://doi.org/10.1038/nmat3315	journal	May 2012
Influence of apical oxygen on the extent of in-plane exchange interaction in cuprate superconductors Peng, Y. Y.; Dellea, G.; Minola, M. Nature Physics, Vol. 13, Issue 12 https://doi.org/10.1038/nphys4248	journal	August 2017
Structural absorption by barbule microstructures of super black bird of paradise feathers McCoy, Dakota E.; Feo, Teresa; Harvey, Todd Alan Nature Communications, Vol. 9, Issue 1 https://doi.org/10.1038/s41467-017-02088-w	journal	January 2018
Comprehensive phase diagram of two-dimensional space charge doped Bi2Sr2CaCu2O8+x Sterpetti, Edoardo; Biscaras, Johan; Erb, Andreas Nature Communications, Vol. 8, Issue 1 https://doi.org/10.1038/s41467-017-02104-z	journal	December 2017
Efficient first-principles prediction of solid stability: Towards chemical accuracy Zhang, Yubo; Kitchaev, Daniil A.; Yang, Julia npj Computational Materials, Vol. 4, Issue 1 https://doi.org/10.1038/s41524-018-0065-z	journal	March 2018
High-temperature superconductivity in monolayer Bi2Sr2CaCu2O8+δ Yu, Yijun; Ma, Liguo; Cai, Peng Nature, Vol. 575, Issue 7781 https://doi.org/10.1038/s41586-019-1718-x	journal	October 2019
An accurate first-principles treatment of doping-dependent electronic structure of high-temperature cuprate superconductors Furness, James W.; Zhang, Yubo; Lane, Christopher Communications Physics, Vol. 1, Issue 1 https://doi.org/10.1038/s42005-018-0009-4	journal	March 2018
Direct theoretical evidence for weaker correlations in electron-doped and Hg-based hole-doped cuprates Jang, Seung Woo; Sakakibara, Hirofumi; Kino, Hiori Scientific Reports, Vol. 6, Issue 1 https://doi.org/10.1038/srep33397	journal	September 2016
Characterization of Thin Film Materials using SCAN meta-GGA, an Accurate Nonempirical Density Functional Buda, I. G.; Lane, C.; Barbiellini, B. Scientific Reports, Vol. 7, Issue 1 https://doi.org/10.1038/srep44766	journal	March 2017
Competing ferromagnetism in high-temperature copper oxide superconductors Kopp, A.; Ghosal, A.; Chakravarty, S. Proceedings of the National Academy of Sciences, Vol. 104, Issue 15 https://doi.org/10.1073/pnas.0701265104	journal	April 2007
Higher superconducting transition temperature by breaking the universal pressure relation Deng, Liangzi; Zheng, Yongping; Wu, Zheng Proceedings of the National Academy of Sciences, Vol. 116, Issue 6 https://doi.org/10.1073/pnas.1819512116	journal	January 2019
Competing stripe and magnetic phases in the cuprates from first principles Zhang, Yubo; Lane, Christopher; Furness, James W. Proceedings of the National Academy of Sciences, Vol. 117, Issue 1 https://doi.org/10.1073/pnas.1910411116	journal	December 2019
Intermediate coupling model of the cuprates Das, Tanmoy; Markiewicz, R. S.; Bansil, A. Advances in Physics, Vol. 63, Issue 3 https://doi.org/10.1080/00018732.2014.940227	journal	May 2014
Disappearance of Superconductivity and a Concomitant Lifshitz Transition in Heavily Overdoped Bi ₂ Sr ₂ CuO ₆ Superconductor Revealed by Angle-Resolved Photoemission Spectroscopy Ding, Ying; Zhao, Lin; Yan, Hong-Tao Chinese Physics Letters, Vol. 36, Issue 1 https://doi.org/10.1088/0256-307X/36/1/017402	journal	December 2018
Distinct Superconducting Gap on Two Bilayer-Split Fermi Surface Sheets in Bi ₂ Sr ₂ CaCu ₂ O _{8+ δ} Superconductor Ai, Ping; Gao, Qiang; Liu, Jing Chinese Physics Letters, Vol. 36, Issue 6 https://doi.org/10.1088/0256-307X/36/6/067402	journal	May 2019
The modulation and reconstruction of a BiO layer of cuprate Bi2212 Fan, Wei; Zeng, Z. Superconductor Science and Technology, Vol. 24, Issue 10 https://doi.org/10.1088/0953-2048/24/10/105007	journal	August 2011
Evolution of incommensurate superstructure and electronic structure with Pb substitution in (Bi _{2− x} Pb _x )Sr ₂ CaCu ₂ O _{8+ δ} superconductors Liu, Jing; Zhao, Lin; Gao, Qiang Chinese Physics B, Vol. 28, Issue 7 https://doi.org/10.1088/1674-1056/28/7/077403	journal	July 2019
Mott gapping in 3 d A B O 3 perovskites without Mott-Hubbard interelectronic repulsion energy U Varignon, Julien; Bibes, Manuel; Zunger, Alex Physical Review B, Vol. 100, Issue 3 https://doi.org/10.1103/PhysRevB.100.035119	journal	July 2019
Analysis of over-magnetization of elemental transition metal solids from the SCAN density functional Mejía-Rodríguez, Daniel; Trickey, S. B. Physical Review B, Vol. 100, Issue 4 https://doi.org/10.1103/PhysRevB.100.041113	journal	July 2019
Identification of ferrimagnetic orbitals preventing spinel degradation by charge ordering in Li x Mn 2 O 4 Hafiz, Hasnain; Suzuki, Kosuke; Barbiellini, Bernardo Physical Review B, Vol. 100, Issue 20 https://doi.org/10.1103/PhysRevB.100.205104	journal	November 2019
Coulomb correlation in noncollinear antiferromagnetic α -Mn Pulkkinen, Aki; Barbiellini, Bernardo; Nokelainen, Johannes Physical Review B, Vol. 101, Issue 7 https://doi.org/10.1103/PhysRevB.101.075115	journal	February 2020
First-principles calculation of spin and orbital contributions to magnetically ordered moments in Sr 2 IrO 4 Lane, Christopher; Zhang, Yubo; Furness, James W. Physical Review B, Vol. 101, Issue 15 https://doi.org/10.1103/PhysRevB.101.155110	journal	April 2020
d -wave pairing near a spin-density-wave instability Scalapino, D. J.; Loh, E.; Hirsch, J. E. Physical Review B, Vol. 34, Issue 11 https://doi.org/10.1103/PhysRevB.34.8190	journal	December 1986
Origin of the 110-K superconducting transition in the Bi-Sr-Ca-Cu-O system Tarascon, J. M.; LePage, Y.; Greene, L. H. Physical Review B, Vol. 38, Issue 4 https://doi.org/10.1103/PhysRevB.38.2504	journal	August 1988
Electronic band properties of CaSr 2 Bi 2 Cu 2 O 8 Mattheiss, L. F.; Hamann, D. R. Physical Review B, Vol. 38, Issue 7 https://doi.org/10.1103/PhysRevB.38.5012	journal	September 1988
Preparation, structure, and properties of the superconducting compound series Bi 2 Sr 2 Ca n − 1 Cu n O y with n = 1 , 2 , and 3 Tarascon, J. M.; McKinnon, W. R.; Barboux, P. Physical Review B, Vol. 38, Issue 13 https://doi.org/10.1103/PhysRevB.38.8885	journal	November 1988
Band theory and Mott insulators: Hubbard U instead of Stoner I Anisimov, Vladimir I.; Zaanen, Jan; Andersen, Ole K. Physical Review B, Vol. 44, Issue 3, p. 943-954 https://doi.org/10.1103/PhysRevB.44.943	journal	July 1991
Projector augmented-wave method Blöchl, P. E. Physical Review B, Vol. 50, Issue 24, p. 17953-17979 https://doi.org/10.1103/PhysRevB.50.17953	journal	December 1994
Synthesis and magnetism of Bi 2 Sr 2 R Cu 2 O 8 + δ ( R =Y, Pr, and Tb) systems Awana, V. P. S.; Menon, Latika; Malik, S. K. Physical Review B, Vol. 51, Issue 14 https://doi.org/10.1103/PhysRevB.51.9379	journal	April 1995
Efficient iterative schemes for ab initio total-energy calculations using a plane-wave basis set Kresse, G.; Furthmüller, J. Physical Review B, Vol. 54, Issue 16, p. 11169-11186 https://doi.org/10.1103/PhysRevB.54.11169	journal	October 1996
From ultrasoft pseudopotentials to the projector augmented-wave method Kresse, G.; Joubert, D. Physical Review B, Vol. 59, Issue 3, p. 1758-1775 https://doi.org/10.1103/PhysRevB.59.1758	journal	January 1999
Supermodulation in the atomic structure of the superconductor Bi 2 Sr 2 Ca Cu 2 O 8 + x from ab initio calculations He, Y.; Graser, S.; Hirschfeld, P. J. Physical Review B, Vol. 77, Issue 22 https://doi.org/10.1103/PhysRevB.77.220507	journal	June 2008
Modulation of pairing interaction in Bi 2 Sr 2 CaCu 2 O 8 + δ by an O dopant: A density functional theory study Foyevtsova, Kateryna; Kandpal, H. C.; Jeschke, Harald O. Physical Review B, Vol. 82, Issue 5 https://doi.org/10.1103/PhysRevB.82.054514	journal	August 2010
Effect of orbital symmetry of the tip on scanning tunneling spectra of Bi 2 Sr 2 CaCu 2 O 8 + δ Suominen, Ilpo; Nieminen, Jouko; Markiewicz, R. S. Physical Review B, Vol. 84, Issue 1 https://doi.org/10.1103/PhysRevB.84.014528	journal	July 2011
Spatial inhomogeneity and planar symmetry breaking of the lattice incommensurate supermodulation in the high-temperature superconductor Bi 2 Sr 2 CaCu 2 O 8 + y Poccia, Nicola; Campi, Gaetano; Fratini, Michela Physical Review B, Vol. 84, Issue 10 https://doi.org/10.1103/PhysRevB.84.100504	journal	September 2011
Evidence of strong correlations at the van Hove singularity in the scanning tunneling spectra of superconducting Bi 2 Sr 2 CaCu 2 O 8 + δ single crystals Nieminen, Jouko; Suominen, Ilpo; Das, Tanmoy Physical Review B, Vol. 85, Issue 21 https://doi.org/10.1103/PhysRevB.85.214504	journal	June 2012
Recovering hidden Bloch character: Unfolding electrons, phonons, and slabs Allen, P. B.; Berlijn, T.; Casavant, D. A. Physical Review B, Vol. 87, Issue 8 https://doi.org/10.1103/PhysRevB.87.085322	journal	February 2013
Effects of extrinsic and intrinsic perturbations on the electronic structure of graphene: Retaining an effective primitive cell band structure by band unfolding Medeiros, Paulo V. C.; Stafström, Sven; Björk, Jonas Physical Review B, Vol. 89, Issue 4 https://doi.org/10.1103/PhysRevB.89.041407	journal	January 2014
Resolving unoccupied electronic states with laser ARPES in bismuth-based cuprate superconductors Miller, Tristan L.; Ärrälä, Minna; Smallwood, Christopher L. Physical Review B, Vol. 91, Issue 8 https://doi.org/10.1103/PhysRevB.91.085109	journal	February 2015
Nanoscale phase separation in deeply underdoped Bi 2 Sr 2 CuO 6 + δ and Ca 2 CuO 2 Cl 2 Mistark, Peter; Markiewicz, Robert S.; Bansil, Arun Physical Review B, Vol. 91, Issue 14 https://doi.org/10.1103/PhysRevB.91.140501	journal	April 2015
Direct observation of charge order in underdoped and optimally doped Bi 2 ( Sr , La ) 2 CuO 6 + δ by resonant inelastic x-ray scattering Peng, Y. Y.; Salluzzo, M.; Sun, X. Physical Review B, Vol. 94, Issue 18 https://doi.org/10.1103/PhysRevB.94.184511	journal	November 2016
Revealing the Coulomb interaction strength in a cuprate superconductor Yang, S. -L.; Sobota, J. A.; He, Y. Physical Review B, Vol. 96, Issue 24 https://doi.org/10.1103/PhysRevB.96.245112	journal	December 2017
Antiferromagnetic ground state of La 2 CuO 4 : A parameter-free ab initio description Lane, Christopher; Furness, James W.; Buda, Ioana Gianina Physical Review B, Vol. 98, Issue 12 https://doi.org/10.1103/PhysRevB.98.125140	journal	September 2018
Dispersion, damping, and intensity of spin excitations in the monolayer ( Bi,Pb ) 2 ( Sr,La ) 2 CuO 6 + δ cuprate superconductor family Peng, Y. Y.; Huang, E. W.; Fumagalli, R. Physical Review B, Vol. 98, Issue 14 https://doi.org/10.1103/PhysRevB.98.144507	journal	October 2018
Atomic-layer-resolved composition and electronic structure of the cuprate B i 2 S r 2 CaC u 2 O 8 + δ from soft x-ray standing-wave photoemission Kuo, Cheng-Tai; Lin, Shih-Chieh; Conti, Giuseppina Physical Review B, Vol. 98, Issue 15 https://doi.org/10.1103/PhysRevB.98.155133	journal	October 2018
Enhancing the efficiency of density functionals with an improved iso-orbital indicator Furness, James W.; Sun, Jianwei Physical Review B, Vol. 99, Issue 4 https://doi.org/10.1103/PhysRevB.99.041119	journal	January 2019
Importance of Local Band Effects for Ferromagnetism in Hole-Doped La 2 CuO 4 Cuprate Superconductors Barbiellini, B.; Jarlborg, T. Physical Review Letters, Vol. 101, Issue 15 https://doi.org/10.1103/PhysRevLett.101.157002	journal	October 2008
Two-Orbital Model Explains the Higher Transition Temperature of the Single-Layer Hg-Cuprate Superconductor Compared to That of the La-Cuprate Superconductor Sakakibara, Hirofumi; Usui, Hidetomo; Kuroki, Kazuhiko Physical Review Letters, Vol. 105, Issue 5 https://doi.org/10.1103/PhysRevLett.105.057003	journal	July 2010
Strongly Constrained and Appropriately Normed Semilocal Density Functional Sun, Jianwei; Ruzsinszky, Adrienn; Perdew, John P. Physical Review Letters, Vol. 115, Issue 3 https://doi.org/10.1103/PhysRevLett.115.036402	journal	July 2015
Development of Ferromagnetic Fluctuations in Heavily Overdoped ( Bi , Pb ) 2 Sr 2 CuO 6 + δ Copper Oxides Kurashima, Koshi; Adachi, Tadashi; Suzuki, Kensuke M. Physical Review Letters, Vol. 121, Issue 5 https://doi.org/10.1103/PhysRevLett.121.057002	journal	August 2018
Applicability of the Strongly Constrained and Appropriately Normed Density Functional to Transition-Metal Magnetism Fu, Yuhao; Singh, David J. Physical Review Letters, Vol. 121, Issue 20 https://doi.org/10.1103/PhysRevLett.121.207201	journal	November 2018
Sign-Reversing Hall Effect in Atomically Thin High-Temperature Bi 2.1 Sr 1.9 CaCu 2.0 O 8 + δ Superconductors Zhao, S. Y. Frank; Poccia, Nicola; Panetta, Margaret G. Physical Review Letters, Vol. 122, Issue 24 https://doi.org/10.1103/PhysRevLett.122.247001	journal	June 2019
Effect of Structural Supermodulation on Superconductivity in Trilayer Cuprate Bi 2 Sr 2 Ca 2 Cu 3 O 10 + δ Zou, Changwei; Hao, Zhenqi; Li, Haiwei Physical Review Letters, Vol. 124, Issue 4 https://doi.org/10.1103/PhysRevLett.124.047003	journal	January 2020
Electronic band structure of CaBi 2 Sr 2 Cu 2 O 8 Hybertsen, Mark S.; Mattheiss, L. F. Physical Review Letters, Vol. 60, Issue 16 https://doi.org/10.1103/PhysRevLett.60.1661	journal	April 1988
Pair momentum distribution in Bi 2 Sr 2 CaCu 2 O 8 + δ measured by positron annihilation: Existence and nature of the Fermi surface Chan, L. P.; Harshman, D. R.; Lynn, K. G. Physical Review Letters, Vol. 67, Issue 10 https://doi.org/10.1103/PhysRevLett.67.1350	journal	September 1991
Complete Fermi surface mapping of Bi 2 Sr 2 CaCu 2 O 8 + x (001): Coexistence of short range antiferromagnetic correlations and metallicity in the same phase Aebi, P.; Osterwalder, J.; Schwaller, P. Physical Review Letters, Vol. 72, Issue 17 https://doi.org/10.1103/PhysRevLett.72.2757	journal	April 1994
Generalized Gradient Approximation Made Simple Perdew, John P.; Burke, Kieron; Ernzerhof, Matthias Physical Review Letters, Vol. 77, Issue 18, p. 3865-3868 https://doi.org/10.1103/PhysRevLett.77.3865	journal	October 1996
Topology of the Pseudogap and Shadow Bands in Bi 2 Sr 2 CaCu 2 O 8 + δ at Optimum Doping Saini, N. L.; Avila, J.; Bianconi, A. Physical Review Letters, Vol. 79, Issue 18 https://doi.org/10.1103/PhysRevLett.79.3467	journal	November 1997
Band-Structure Trend in Hole-Doped Cuprates and Correlation with T c max Pavarini, E.; Dasgupta, I.; Saha-Dasgupta, T. Physical Review Letters, Vol. 87, Issue 4 https://doi.org/10.1103/PhysRevLett.87.047003	journal	July 2001
Coherent Quasiparticle Weight and Its Connection to High- T c Superconductivity from Angle-Resolved Photoemission Ding, H.; Engelbrecht, J. R.; Wang, Z. Physical Review Letters, Vol. 87, Issue 22 https://doi.org/10.1103/PhysRevLett.87.227001	journal	November 2001
Gap-Inhomogeneity-Induced Electronic States in Superconducting Bi 2 Sr 2 CaCu 2 O 8 + δ Fang, A. C.; Capriotti, L.; Scalapino, D. J. Physical Review Letters, Vol. 96, Issue 1 https://doi.org/10.1103/PhysRevLett.96.017007	journal	January 2006
Raising Bi-O Bands above the Fermi Energy Level of Hole-Doped Bi 2 Sr 2 CaCu 2 O 8 + δ and Other Cuprate Superconductors Lin, Hsin; Sahrakorpi, S.; Markiewicz, R. S. Physical Review Letters, Vol. 96, Issue 9 https://doi.org/10.1103/PhysRevLett.96.097001	journal	March 2006
Local Electronic Structure of Bi 2 Sr 2 CaCu 2 O 8 near Oxygen Dopants: A Window on the High- T c Pairing Mechanism He, Y.; Nunner, T. S.; Hirschfeld, P. J. Physical Review Letters, Vol. 96, Issue 19 https://doi.org/10.1103/PhysRevLett.96.197002	journal	May 2006
Performance of the strongly constrained and appropriately normed density functional for solid-state materials Isaacs, Eric B.; Wolverton, Chris Physical Review Materials, Vol. 2, Issue 6 https://doi.org/10.1103/PhysRevMaterials.2.063801	journal	June 2018
Electronic structure of the high-temperature oxide superconductors Pickett, Warren E. Reviews of Modern Physics, Vol. 61, Issue 2 https://doi.org/10.1103/RevModPhys.61.433	journal	April 1989
Nobel Lecture: Electronic structure of matter—wave functions and density functionals Kohn, W. Reviews of Modern Physics, Vol. 71, Issue 5 https://doi.org/10.1103/RevModPhys.71.1253	journal	October 1999
Angle-resolved photoemission studies of the cuprate superconductors Damascelli, Andrea; Hussain, Zahid; Shen, Zhi-Xun Reviews of Modern Physics, Vol. 75, Issue 2 https://doi.org/10.1103/RevModPhys.75.473	journal	April 2003
Scanning tunneling spectroscopy of high-temperature superconductors Fischer, Øystein; Kugler, Martin; Maggio-Aprile, Ivan Reviews of Modern Physics, Vol. 79, Issue 1 https://doi.org/10.1103/RevModPhys.79.353	journal	March 2007
A common thread: The pairing interaction for unconventional superconductors Scalapino, D. J. Reviews of Modern Physics, Vol. 84, Issue 4 https://doi.org/10.1103/RevModPhys.84.1383	journal	October 2012
Complexity in Strongly Correlated Electronic Systems Dagotto, E. Science, Vol. 309, Issue 5732 https://doi.org/10.1126/science.1107559	journal	July 2005
Imaging the Impact of Single Oxygen Atoms on Superconducting Bi2+ySr2-yCaCu2O8+x Zeljkovic, I.; Xu, Z.; Wen, J. Science, Vol. 337, Issue 6092 https://doi.org/10.1126/science.1218648	journal	July 2012
A New High-Temperature Superconductor: Bi2Sr3-x Cax Cu2O8+y Subramanian, M. A.; Torardi, C. C.; Calabrese, J. C. Science, Vol. 239, Issue 4843 https://doi.org/10.1126/science.239.4843.1015	journal	February 1988
Revealing hidden spin-momentum locking in a high-temperature cuprate superconductor Gotlieb, Kenneth; Lin, Chiu-Yun; Serbyn, Maksym Science, Vol. 362, Issue 6420 https://doi.org/10.1126/science.aao0980	journal	December 2018
Single Crystal X-Ray Structure Analysis of Bi ₂ (Sr, Ca) ₂ CuO _x and Bi ₂ (Sr, Ca) ₃ Cu ₂ O _x Superconductors Imai, Katsuhiro; Nakai, Izumi; Kawashima, Takuji Japanese Journal of Applied Physics, Vol. 27, Issue Part 2, No. 9 https://doi.org/10.1143/JJAP.27.L1661	journal	September 1988
Supercell Band Calculations and Correlation for High- Copper Oxide Superconductors Jarlborg, T. Advances in Condensed Matter Physics, Vol. 2010 https://doi.org/10.1155/2010/912067	journal	January 2010

Similar Records

Nematic fluctuations in the cuprate superconductor Bi₂Sr₂CaCu₂O_8+δ

Journal Article · Thu Nov 14 19:00:00 EST 2019 · Nature Communications · OSTI ID:1583110

Phase diagram of Bi₂Sr₂CaCu₂O_8+δ revisited

Journal Article · Wed Dec 05 19:00:00 EST 2018 · Nature Communications · OSTI ID:1488523

Related Subjects

75 CONDENSED MATTER PHYSICS
SUPERCONDUCTIVITY AND SUPERFLUIDITY
Material Science

Ab initio description of the Bi2Sr2CaCu2O8+δ electronic structure

Citation Formats

References (94)

Similar Records

Related Subjects

Ab initio description of the Bi₂Sr₂CaCu₂O_8+δ electronic structure