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Journal Articles
Effect of carrier dynamics on mode shift in the ultrafast timescale of perovskite microlasers
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Journal:
The Journal of Chemical Physics
J. Chem. Phys. 162, 194705 (2025)
Published: May 2025
Journal Articles
Atomic deuterium bonding to multi-walled carbon nano tubes
Available to PurchaseSammar Tayyab, Alice Apponi, Maria Grazia Betti, Elena Blundo, Orlando Castellano, Gianluca Cavoto, Francesco Pandolfi, Antonio Polimeni, Ilaria Rago, Alessandro Ruocco, Ravi Prakash Yadav, Carlo Mariani
Journal:
The Journal of Chemical Physics
J. Chem. Phys. 162, 194704 (2025)
Published: May 2025
Journal Articles
Sn9C15 monolayer with desirable bandgap, high carrier mobilities, and broadband light absorption for photovoltaic devices
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Journal:
The Journal of Chemical Physics
J. Chem. Phys. 162, 134704 (2025)
Published: April 2025
Journal Articles
Journal Articles
Accurate DFT simulation of complex functional materials: Synergistic enhancements achieved by SCAN meta-GGA
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Journal:
The Journal of Chemical Physics
J. Chem. Phys. 162, 014107 (2025)
Published: January 2025
Journal Articles
First-principles investigation of oxidized Si- and Ge-terminated diamond (100) surfaces
Available to PurchaseH. Gomez, Jr., J. Cruz, C. Milne, T. Debnath, A. G. Birdwell, E. J. Garratt, B. B. Pate, S. Rudin, D. A. Ruzmetov, J. D. Weil, P. B. Shah, T. G. Ivanov, R. K. Lake, M. N. Groves, M. R. Neupane
Journal:
The Journal of Chemical Physics
J. Chem. Phys. 161, 064702 (2024)
Published: August 2024
Journal Articles
Alexis R. Myers, Dana B. Sulas-Kern, Rao Fei, Debjit Ghoshal, M. Alejandra Hermosilla-Palacios, Jeffrey L. Blackburn
Journal:
The Journal of Chemical Physics
J. Chem. Phys. 161, 044706 (2024)
Published: July 2024
Journal Articles
Novel S–N/WO3: Optimization of photocatalytic performance of WO3 by simultaneous existence of S and N in WO3 against MB dye
Available to PurchaseAyesha Younas, Rana Mustansar Munir, Hassan Imam Rizvi, Tahir Iqbal, Sumera Afsheen, K. N. Riaz, Asad Syed, Abdallah M. Elgorban, Ling Shing Wong
Journal:
The Journal of Chemical Physics
J. Chem. Phys. 160, 244201 (2024)
Published: June 2024
Journal Articles
A way to identify whether a DFT gap is from right reasons or error cancellations: The case of copper chalcogenides
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Journal:
The Journal of Chemical Physics
J. Chem. Phys. 160, 244704 (2024)
Published: June 2024
Journal Articles
Journal Articles
First-principles design of heavy-atom-free singlet oxygen photosensitizers for photodynamic therapy
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Journal:
The Journal of Chemical Physics
J. Chem. Phys. 160, 164720 (2024)
Published: April 2024
Includes: Supplementary data
Journal Articles
Thickness-dependent electronic relaxation dynamics in solution-phase redox-exfoliated MoS2 heterostructures
Journal:
The Journal of Chemical Physics
J. Chem. Phys. 160, 144707 (2024)
Published: April 2024
Includes: Supplementary data
Journal Articles
Electronic and spin states at edges of finite p-orbital helical atomic chain
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Journal:
The Journal of Chemical Physics
J. Chem. Phys. 159, 244101 (2023)
Published: December 2023
Journal Articles
Temperature dependent charge carrier dynamics in 2D ternary Cu2MoS4 nanoflakes: An effect of electron-phonon coupling
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Journal:
The Journal of Chemical Physics
J. Chem. Phys. 159, 174705 (2023)
Published: November 2023
Includes: Supplementary data
Journal Articles
Stark control of electrons across the molecule–semiconductor interface
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Journal:
The Journal of Chemical Physics
J. Chem. Phys. 159, 044704 (2023)
Published: July 2023
Journal Articles
Development of Cu–In–Ga–S quantum dots with a narrow emission peak for red electroluminescence
Available to PurchaseChang Jiang, Makoto Tozawa, Kazutaka Akiyoshi, Tatsuya Kameyama, Takahisa Yamamoto, Genichi Motomura, Yoshihide Fujisaki, Taro Uematsu, Susumu Kuwabata, Tsukasa Torimoto
Journal:
The Journal of Chemical Physics
J. Chem. Phys. 158, 164708 (2023)
Published: April 2023
Includes: Supplementary data
Journal Articles
On the self-consistency of DFT-1/2
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Journal:
The Journal of Chemical Physics
J. Chem. Phys. 158, 094103 (2023)
Published: March 2023
Journal Articles
Ferroelectric water chains in carbon nanotubes: Creation and manipulation of ordered quantum phases
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Journal:
The Journal of Chemical Physics
J. Chem. Phys. 157, 234301 (2022)
Published: December 2022
Journal Articles
Journal:
The Journal of Chemical Physics
J. Chem. Phys. 157, 124111 (2022)
Published: September 2022
Journal Articles
Hardness of molecules and bandgap of solids from a generalized gradient approximation exchange energy functional
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Journal:
The Journal of Chemical Physics
J. Chem. Phys. 157, 114109 (2022)
Published: September 2022
Includes: Supplementary data
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