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Journal Articles

Recent advances in the SISSO method and their implementation in the SISSO++ code

Thomas A. R. Purcell, Matthias Scheffler, Luca M. Ghiringhelli

J. Chem. Phys. 159, 114110 (2023)

https://doi.org/10.1063/5.0156620

Published: September 2023

View article titled, Recent advances in the SISSO method and their implementation in the SISSO++ code

Journal Articles

Chirality induced spin selectivity in chiral hybrid organic–inorganic perovskites

Jingying Wang, Baorui Mao, Zeev Valy Vardeny

J. Chem. Phys. 159, 091002 (2023)

https://doi.org/10.1063/5.0160032

Published: September 2023

View article titled, Chirality induced spin selectivity in chiral hybrid organic–inorganic perovskites

Journal Articles

Measuring carrier diffusion in MAPbI₃ solar cells with photocurrent-detected transient grating spectroscopy

Zhenyu Ouyang, Zijian Gan, Liang Yan, Wei You, Andrew M. Moran

J. Chem. Phys. 159, 094201 (2023)

https://doi.org/10.1063/5.0159301

Published: September 2023

View article titled, Measuring carrier diffusion in MAPbI3 solar cells with photocurrent-detected transient grating spectroscopy

Includes: Supplementary data

Journal Articles

A combination of fluorine-induced effect and co-sensitization for highly efficient and stable dye-sensitized solar cells

Shengbo Zhu, Wei Li, Bingyang Lu, Ran Chen, Yongliang Liu, Weixing Chen, Xiaoling Niu, Wenzhi Zhang, Xinbing Chen, Zhongwei An

J. Chem. Phys. 159, 084704 (2023)

https://doi.org/10.1063/5.0158154

Published: August 2023

View article titled, A combination of fluorine-induced effect and co-sensitization for highly efficient and stable dye-sensitized solar cells

Includes: Supplementary data

Journal Articles

Oxygen and moisture-induced healing of halide double perovskite surface defects

Bhawna, Aftab Alam, M. Aslam

J. Chem. Phys. 159, 084703 (2023)

https://doi.org/10.1063/5.0154047

Published: August 2023

View article titled, Oxygen and moisture-induced healing of halide double perovskite surface defects

Includes: Supplementary data

Journal Articles

First-principles property assessment of hybrid formate perovskites

Abduljelili Popoola, P. S. Ghosh, Maggie Kingsland, Ravi Kashikar, D. DeTellem, Yixuan Xu, S. Ma, S. Witanachchi, S. Lisenkov, I. Ponomareva

J. Chem. Phys. 159, 074702 (2023)

https://doi.org/10.1063/5.0159526

Published: August 2023

View article titled, First-principles property assessment of hybrid formate perovskites

Includes: Supplementary data

Journal Articles

The physics of plasmon-driven energy conversion

Prashant K. Jain, Zee Hwan Kim, Wei David Wei

J. Chem. Phys. 159, 070401 (2023)

https://doi.org/10.1063/5.0168581

Published: August 2023

View article titled, The physics of plasmon-driven energy conversion

Journal Articles

Pyrovskite: A software package for the high-throughput construction, analysis, and featurization of two- and three-dimensional perovskite systems

Robert Stanton, Dhara J. Trivedi

J. Chem. Phys. 159, 064803 (2023)

https://doi.org/10.1063/5.0159407

Published: August 2023

View article titled, Pyrovskite: A software package for the high-throughput construction, analysis, and featurization of two- and three-dimensional perovskite systems

Includes: Supplementary data

Journal Articles

Influence of vibronic interaction of charge transfer excitons in PTB7/BTA-based nonfullerene organic solar cells

Sumire Ikeyama, Azusa Muraoka

J. Chem. Phys. 159, 044307 (2023)

https://doi.org/10.1063/5.0150140

Published: July 2023

View article titled, Influence of vibronic interaction of charge transfer excitons in PTB7/BTA-based nonfullerene organic solar cells

Includes: Supplementary data

Journal Articles

Photophysics in emerging photovoltaics

Nicholas E. Jackson, Joseph M. Luther, Brett M. Savoie, Kaifeng Wu

J. Chem. Phys. 159, 020401 (2023)

https://doi.org/10.1063/5.0161842

Published: July 2023

View article titled, Photophysics in emerging photovoltaics

Journal Articles

Size-dependent miscibility controls the kinetics of anion exchange in cesium lead halide nanocrystals

Dongyan Zhang, Xinyi Sarah Wu, Dong Wang, Bryce Sadtler

J. Chem. Phys. 159, 014701 (2023)

https://doi.org/10.1063/5.0149821

Published: July 2023

View article titled, Size-dependent miscibility controls the kinetics of anion exchange in cesium lead halide nanocrystals

Includes: Supplementary data

Journal Articles

Improving photovoltaic performance of light-responsive double-heterojunction nanorod light-emitting diodes

Conan Huang, Yiran Jiang, Gryphon A. Drake, Logan P. Keating, Moonsub Shim

J. Chem. Phys. 158, 244701 (2023)

https://doi.org/10.1063/5.0147782

Published: June 2023

View article titled, Improving photovoltaic performance of light-responsive double-heterojunction nanorod light-emitting diodes

Includes: Supplementary data

Journal Articles

Ca²⁺ enhanced far-red emission performance and efficiency of SrGd₂Al₂O₇:Mn⁴⁺ phosphor for the potential application in plant growth lighting

Yi Yu, Kai Shao, Chonghui Niu, Mingjie Dan, Zhibin Wang, Yingying Wang, Jie Chen, Jiani Luo, Shiying Liu, Zhi Xie

J. Chem. Phys. 158, 234703 (2023)

https://doi.org/10.1063/5.0149120

Published: June 2023

View article titled, Ca2+ enhanced far-red emission performance and efficiency of SrGd2Al2O7:Mn4+ phosphor for the potential application in plant growth lighting

Includes: Supplementary data

Journal Articles

Hot electron relaxation in Type-II quantum wells

Hua Wang, Mario F. Borunda, Kieran J. Mullen

J. Chem. Phys. 158, 204711 (2023)

https://doi.org/10.1063/5.0134031

Published: May 2023

View article titled, Hot electron relaxation in Type-II quantum wells

Includes: Supplementary data

Journal Articles

Temperature dependence of photoluminescence spectrum of single lead halide perovskite nanocrystals: Effect of size on the phase transition temperature

Kenichi Cho, Takumi Yamada, Masaki Saruyama, Ryota Sato, Toshiharu Teranishi, Yoshihiko Kanemitsu

J. Chem. Phys. 158, 201104 (2023)

https://doi.org/10.1063/5.0143201

Published: May 2023

View article titled, Temperature dependence of photoluminescence spectrum of single lead halide perovskite nanocrystals: Effect of size on the phase transition temperature

Journal Articles

Deep ensembles vs committees for uncertainty estimation in neural-network force fields: Comparison and application to active learning

Jesús Carrete, Hadrián Montes-Campos, Ralf Wanzenböck, Esther Heid, Georg K. H. Madsen

J. Chem. Phys. 158, 204801 (2023)

https://doi.org/10.1063/5.0146905

Published: May 2023

View article titled, Deep ensembles vs committees for uncertainty estimation in neural-network force fields: Comparison and application to active learning

Journal Articles

The complex permittivity of PEDOT:PSS

Faramarz Hossein-Babaei, Ebrahim Chegini

J. Chem. Phys. 158, 194904 (2023)

https://doi.org/10.1063/5.0142523

Published: May 2023

View article titled, The complex permittivity of PEDOT:PSS

Includes: Supplementary data

Journal Articles

The surface chemistry of ionic liquid-treated CsPbBr₃ quantum dots

Kyle D. Crans, Matthew Bain, Stephen E. Bradforth, Dan Oron, Miri Kazes, Richard L. Brutchey

J. Chem. Phys. 158, 174709 (2023)

https://doi.org/10.1063/5.0147918

Published: May 2023

View article titled, The surface chemistry of ionic liquid-treated CsPbBr3 quantum dots

Includes: Supplementary data

Journal Articles

Impact of cation modification on phonon-dressed exciton dynamics in a prototype two-dimensional hybrid organic–inorganic perovskite system

Zhoushilin Ruan, Shenlong Jiang, Qun Zhang

J. Chem. Phys. 158, 164706 (2023)

https://doi.org/10.1063/5.0145925

Published: April 2023

View article titled, Impact of cation modification on phonon-dressed exciton dynamics in a prototype two-dimensional hybrid organic–inorganic perovskite system

Includes: Supplementary data

Journal Articles

Near-infrared absorption of fused core-modified expanded porphyrins for dye-sensitized solar cells

María Isabel Menéndez, Nicolas Montenegro-Pohlhammer, Ricardo Pino-Rios, Rodrigo Urzúa-Leiva, Simone Morales-Lovera, Merlys Borges-Martínez, Kevin Granados-Tavera, Ramón López, Gloria Cárdenas-Jirón

J. Chem. Phys. 158, 164305 (2023)

https://doi.org/10.1063/5.0143835

Published: April 2023

View article titled, Near-infrared absorption of fused core-modified expanded porphyrins for dye-sensitized solar cells

Includes: Supplementary data

NARROW

Topics

Recent advances in the SISSO method and their implementation in the SISSO++ code

Chirality induced spin selectivity in chiral hybrid organic–inorganic perovskites

Measuring carrier diffusion in MAPbI₃ solar cells with photocurrent-detected transient grating spectroscopy

A combination of fluorine-induced effect and co-sensitization for highly efficient and stable dye-sensitized solar cells

Oxygen and moisture-induced healing of halide double perovskite surface defects

First-principles property assessment of hybrid formate perovskites

The physics of plasmon-driven energy conversion

Pyrovskite: A software package for the high-throughput construction, analysis, and featurization of two- and three-dimensional perovskite systems

Influence of vibronic interaction of charge transfer excitons in PTB7/BTA-based nonfullerene organic solar cells

Photophysics in emerging photovoltaics

Size-dependent miscibility controls the kinetics of anion exchange in cesium lead halide nanocrystals

Improving photovoltaic performance of light-responsive double-heterojunction nanorod light-emitting diodes

Ca²⁺ enhanced far-red emission performance and efficiency of SrGd₂Al₂O₇:Mn⁴⁺ phosphor for the potential application in plant growth lighting

Hot electron relaxation in Type-II quantum wells

Temperature dependence of photoluminescence spectrum of single lead halide perovskite nanocrystals: Effect of size on the phase transition temperature

Deep ensembles vs committees for uncertainty estimation in neural-network force fields: Comparison and application to active learning

The complex permittivity of PEDOT:PSS

The surface chemistry of ionic liquid-treated CsPbBr₃ quantum dots

Impact of cation modification on phonon-dressed exciton dynamics in a prototype two-dimensional hybrid organic–inorganic perovskite system

Near-infrared absorption of fused core-modified expanded porphyrins for dye-sensitized solar cells

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