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Polarity compensation mechanisms on the perovskite surface KTaO3(001)

Science (American Association for the Advancement of Science), 2018-02, Vol.359 (6375), p.572-575

2018

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Competing electronic states emerging on polar surfaces

Nature communications, 2022-07, Vol.13 (1), p.4311-4311, Article 4311

2022

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Anderson transition in stoichiometric Fe2VAl: high thermoelectric performance from impurity bands

Nature communications, 2022-06, Vol.13 (1), p.3599-3599, Article 3599

2022

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Polaron-Driven Surface Reconstructions

Physical review. X, 2017-09, Vol.7 (3), p.031053, Article 031053

2017

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Role of Polarons in Single-Atom Catalysts: Case Study of Me1 [Au1, Pt1, and Rh1] on TiO2(110)

Topics in catalysis, 2022, Vol.65 (17-18), p.1620-1630

2022

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Correction: Role of Polarons in Single-Atom Catalysts: Case Study of Me1 [Au1, Pt1, and Rh1] on TiO2(110)

Topics in catalysis, 2022, Vol.65 (17-18), p.1631-1631

2022

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Machine learning for exploring small polaron configurational space

npj computational materials, 2022-06, Vol.8 (1), p.1-9, Article 125

2022

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Machine learning-based prediction of polaron-vacancy patterns on the TiO2(110) surface

npj computational materials, 2024-12, Vol.10 (1), p.89-9

2024

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Automated real-space lattice extraction for atomic force microscopy images

Machine learning: science and technology, 2023-03, Vol.4 (1), p.15015

2023

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Modeling polarons in density functional theory: lessons learned from TiO2

Journal of physics. Condensed matter, 2022-05, Vol.34 (20)

2022

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Modeling polarons in density functional theory: lessons learned from TiO 2

Journal of physics. Condensed matter, 2022-05, Vol.34 (20), p.204006

2022

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Electronic State Unfolding for Plane Waves: Energy Bands, Fermi Surfaces, and Spectral Functions

Journal of physical chemistry. C, 2021-06, Vol.125 (23), p.12921-12928

2021

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Resolving the adsorption of molecular O₂ on the rutile TiO₂(110) surface by noncontact atomic force microscopy

Proceedings of the National Academy of Sciences - PNAS, 2020-06, Vol.117 (26), p.14827-14837

2020

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Doping-induced insulator-metal transition in the Lifshitz magnetic insulator NaOsO3

Journal of physics. Condensed matter, 2019-06, Vol.31 (24), p.244002-244002

2019

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Resolving the adsorption of molecular O 2 on the rutile TiO 2 (110) surface by noncontact atomic force microscopy

Proceedings of the National Academy of Sciences - PNAS, 2020-06, Vol.117 (26), p.14827-14837

2020

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Small polaron formation on the Nb-doped SrTiO 3 (001) surface

Physical review materials, 2023-06, Vol.7 (6), Article 064602

2023

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Doping-induced insulator-metal transition in the Lifshitz magnetic insulator NaOsO 3

Journal of physics. Condensed matter, 2019-06, Vol.31 (24), p.244002

2019

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Interplay between Adsorbates and Polarons: CO on Rutile TiO^sub 2^ (110)

Physical review letters, 2019-01, Vol.122 (1), p.1

2019

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Interplay between Adsorbates and Polarons: CO on Rutile TiO 2 ( 110 )

Physical review letters, 2019-01, Vol.122 (1), Article 016805

2019

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CuAu, a hexagonal two-dimensional metal

2d materials, 2020-10, Vol.7 (4), p.45017

2020

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Large thermoelectric power factors by opening the band gap in semimetallic Heusler alloys

Materials today physics, 2022-10, Vol.27, p.100742, Article 100742

2022

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Polarity compensation mechanisms on the perovskite surface KTaO 3 (001)

Science (American Association for the Advancement of Science), 2018-02, Vol.359 (6375), p.572-575

2018

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Electron and hole doping in the relativistic Mott insulator Sr2IrO4: A first-principles study using band unfolding technique

Physical review. B, 2016-11, Vol.94 (19)

2016

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Electron and hole doping in the relativistic Mott insulator Sr 2 IrO 4 : A first-principles study using band unfolding technique

Physical review. B, 2016-11, Vol.94 (19), Article 195145

2016

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Formation and dynamics of small polarons on the rutile TiO 2 (110) surface

Physical review. B, 2018-07, Vol.98 (4), Article 045306

2018

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Polarity compensation mechanisms on the perovskite surface KTaO3(001)

Competing electronic states emerging on polar surfaces

Anderson transition in stoichiometric Fe2VAl: high thermoelectric performance from impurity bands

Polaron-Driven Surface Reconstructions

Role of Polarons in Single-Atom Catalysts: Case Study of Me1 [Au1, Pt1, and Rh1] on TiO2(110)

Correction: Role of Polarons in Single-Atom Catalysts: Case Study of Me1 [Au1, Pt1, and Rh1] on TiO2(110)

Machine learning for exploring small polaron configurational space

Machine learning-based prediction of polaron-vacancy patterns on the TiO2(110) surface

Automated real-space lattice extraction for atomic force microscopy images

Modeling polarons in density functional theory: lessons learned from TiO2

Modeling polarons in density functional theory: lessons learned from TiO 2

Electronic State Unfolding for Plane Waves: Energy Bands, Fermi Surfaces, and Spectral Functions

Resolving the adsorption of molecular O₂ on the rutile TiO₂(110) surface by noncontact atomic force microscopy

Doping-induced insulator-metal transition in the Lifshitz magnetic insulator NaOsO3

Resolving the adsorption of molecular O 2 on the rutile TiO 2 (110) surface by noncontact atomic force microscopy

Small polaron formation on the Nb-doped SrTiO 3 (001) surface

Doping-induced insulator-metal transition in the Lifshitz magnetic insulator NaOsO 3

Interplay between Adsorbates and Polarons: CO on Rutile TiO^sub 2^ (110)

Interplay between Adsorbates and Polarons: CO on Rutile TiO 2 ( 110 )

CuAu, a hexagonal two-dimensional metal

Large thermoelectric power factors by opening the band gap in semimetallic Heusler alloys

Polarity compensation mechanisms on the perovskite surface KTaO 3 (001)

Electron and hole doping in the relativistic Mott insulator Sr2IrO4: A first-principles study using band unfolding technique

Electron and hole doping in the relativistic Mott insulator Sr 2 IrO 4 : A first-principles study using band unfolding technique

Formation and dynamics of small polarons on the rutile TiO 2 (110) surface

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