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Journal Articles

Comment on “Surface nuclear spin relaxation of ¹⁹⁹Hg,” [J. Chem. Phys. 120, 1511 (2004)]

S. K. Lamoreaux

J. Chem. Phys. 162, 037101 (2025)

https://doi.org/10.1063/5.0231714

Published: January 2025

View article titled, Comment on “Surface nuclear spin relaxation of 199Hg,” [J. Chem. Phys. 120, 1511 (2004)]

Journal Articles

Electride transition in liquid aluminum under high pressure and high temperature

Yuxin Qin, Xiaoliang Zhang, Shiting Zhou, Yangyang Wang, Gaoyuan Chen, Chen-Min Dai, Weiwei Li, Cong Li

J. Chem. Phys. 162, 014501 (2025)

https://doi.org/10.1063/5.0245648

Published: January 2025

View article titled, Electride transition in liquid aluminum under high pressure and high temperature

Journal Articles

Accurate DFT simulation of complex functional materials: Synergistic enhancements achieved by SCAN meta-GGA

Da Ke, Jianwei Sun, Yubo Zhang

J. Chem. Phys. 162, 014107 (2025)

https://doi.org/10.1063/5.0240018

Published: January 2025

View article titled, Accurate DFT simulation of complex functional materials: Synergistic enhancements achieved by SCAN meta-GGA

Journal Articles

Interband and intraband transitions, as well as charge mobility in driven two-band model with electron–phonon coupling

Yu Wang, Wenjie Dou

J. Chem. Phys. 161, 204104 (2024)

https://doi.org/10.1063/5.0233477

Published: November 2024

View article titled, Interband and intraband transitions, as well as charge mobility in driven two-band model with electron–phonon coupling

Journal Articles

Constructing surface oxygen vacancy in the [Bi₂O₂]²⁺ layer defects mediated Bi₂MoO₆ enhanced visible light responsive photocatalytic activity

Yali Zhu, Rong Wu, Aolin Li, Jialei Hui, Zhilong Zhang, Shunhang Wei

J. Chem. Phys. 161, 184707 (2024)

https://doi.org/10.1063/5.0228635

Published: November 2024

View article titled, Constructing surface oxygen vacancy in the [Bi2O2]2+ layer defects mediated Bi2MoO6 enhanced visible light responsive photocatalytic activity

Journal Articles

Rational design of MoS₂/CNT heterostructure with rich S-vacancy for enhanced HER performance

Yuxin Sun, Jinhua Li, Zhiying Wang, Fengxue Tan, Kaixi Shi, Yingjiao Zhai

J. Chem. Phys. 161, 184705 (2024)

https://doi.org/10.1063/5.0237254

Published: November 2024

View article titled, Rational design of MoS2/CNT heterostructure with rich S-vacancy for enhanced HER performance

Journal Articles

Lifetime mapping using femtosecond time-resolved photoemission electron microscopy

Norman Tze Wei Koo, Kyung Chul Woo, Justin Wei Xiang Lim, Zhi-Heng Loh

J. Chem. Phys. 161, 174201 (2024)

https://doi.org/10.1063/5.0232059

Published: November 2024

View article titled, Lifetime mapping using femtosecond time-resolved photoemission electron microscopy

Journal Articles

Surface weak ferromagnet coupling induced giant room-temperature spontaneous exchange bias in antiferromagnet Fe₃BO₆ polycrystals

Lifeng Wang, Ling Cai, Xiong He, Fanli Yang, Jie Chen, Lizhi Yi, Min Liu, Yunli Xu, Zhengcai Xia, Liqing Pan

J. Chem. Phys. 161, 154706 (2024)

https://doi.org/10.1063/5.0225163

Published: October 2024

View article titled, Surface weak ferromagnet coupling induced giant room-temperature spontaneous exchange bias in antiferromagnet Fe3BO6 polycrystals

Journal Articles

Two-photon absorption in silicon using the real density matrix approach

David Ziemkiewicz, David Knez, Evan P. Garcia, Sylwia Zielińska-Raczyńska, Gerard Czajkowski, Alessandro Salandrino, Sergey S. Kharintsev, Aleksei I. Noskov, Eric O. Potma, Dmitry A. Fishman

J. Chem. Phys. 161, 144117 (2024)

https://doi.org/10.1063/5.0219329

Published: October 2024

View article titled, Two-photon absorption in silicon using the real density matrix approach

Journal Articles

A prediction of high temperature magnetic coupling in transition metal phthalocyanines

James Broadhurst, Giuseppe Mallia, Nicholas Harrison

J. Chem. Phys. 161, 114703 (2024)

https://doi.org/10.1063/5.0218997

Published: September 2024

View article titled, A prediction of high temperature magnetic coupling in transition metal phthalocyanines

Journal Articles

Spin conductances and magnetization production in chiral molecular junctions

Richard Korytár, Jan M. van Ruitenbeek, Ferdinand Evers

J. Chem. Phys. 161, 094111 (2024)

https://doi.org/10.1063/5.0226594

Published: September 2024

View article titled, Spin conductances and magnetization production in chiral molecular junctions

Journal Articles

First-principles study on pressure-induced superconductivity and structural design on transition metal diborides

Chao Zhou, Hongyu Yu, Zihan Zhang, Zekun Yu, Jinming Zhu, Kuo Bao, Tian Cui

J. Chem. Phys. 161, 084712 (2024)

https://doi.org/10.1063/5.0225610

Published: August 2024

View article titled, First-principles study on pressure-induced superconductivity and structural design on transition metal diborides

Journal Articles

First-principles investigation of oxidized Si- and Ge-terminated diamond (100) surfaces

H. 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

J. Chem. Phys. 161, 064702 (2024)

https://doi.org/10.1063/5.0203185

Published: August 2024

View article titled, First-principles investigation of oxidized Si- and Ge-terminated diamond (100) surfaces

Journal Articles

Quantifying carrier density in monolayer MoS₂ by optical spectroscopy

Alexis R. Myers, Dana B. Sulas-Kern, Rao Fei, Debjit Ghoshal, M. Alejandra Hermosilla-Palacios, Jeffrey L. Blackburn

J. Chem. Phys. 161, 044706 (2024)

https://doi.org/10.1063/5.0213720

Published: July 2024

View article titled, Quantifying carrier density in monolayer MoS2 by optical spectroscopy

Journal Articles

Mixed quantum–classical modeling of exciton–phonon scattering in solids: Application to optical linewidths of monolayer MoS₂

Alex Krotz, Roel Tempelaar

J. Chem. Phys. 161, 044117 (2024)

https://doi.org/10.1063/5.0218973

Published: July 2024

View article titled, Mixed quantum–classical modeling of exciton–phonon scattering in solids: Application to optical linewidths of monolayer MoS2

Journal Articles

Raman spectroscopy and photoluminescence study of PN junction p-graphene/n-GaAs

M. Souibgui, H. Ajlani, A. Cavanna, A. Madouri, M. Oueslati, A. Meftah

J. Chem. Phys. 161, 044701 (2024)

https://doi.org/10.1063/5.0211838

Published: July 2024

View article titled, Raman spectroscopy and photoluminescence study of PN junction p-graphene/n-GaAs

Journal Articles

Shedding light on evolution of Raman line shape with probing laser power: Light-induced perturbation in electron–phonon coupling

Omkar V. Rambadey, Kailash Kumar, Ritu Nain, Anil Kumar, Pankaj R. Sagdeo, Philip M. Chamberlin, Kofi W. Adu

J. Chem. Phys. 161, 034202 (2024)

https://doi.org/10.1063/5.0189327

Published: July 2024

View article titled, Shedding light on evolution of Raman line shape with probing laser power: Light-induced perturbation in electron–phonon coupling

Journal Articles

Temperature dependent Raman spectroscopy and sensing performance of 2D black phosphorus

Jiangtao Chen, Xinyi Wang, Tiancheng Song, Ting Wang, Guobin Ma, Xuqiang Zhang, Yun Zhao, Jianbiao Chen, Bingjun Yang, Yan Li

J. Chem. Phys. 161, 034703 (2024)

https://doi.org/10.1063/5.0215386

Published: July 2024

View article titled, Temperature dependent Raman spectroscopy and sensing performance of 2D black phosphorus

Journal Articles

Enhancement of visible light response of TiO₂ photocatalyst by 3D-deposited Ag nanowires and its charge separation mechanism

Masaki Murase, Yuki Matsuoka, Satoshi Sugano, Tetsuro Katayama, Akihiro Furube

J. Chem. Phys. 161, 014701 (2024)

https://doi.org/10.1063/5.0205194

Published: July 2024

View article titled, Enhancement of visible light response of TiO2 photocatalyst by 3D-deposited Ag nanowires and its charge separation mechanism

Journal Articles

Novel S–N/WO₃: Optimization of photocatalytic performance of WO₃ by simultaneous existence of S and N in WO₃ against MB dye

Ayesha Younas, Rana Mustansar Munir, Hassan Imam Rizvi, Tahir Iqbal, Sumera Afsheen, K. N. Riaz, Asad Syed, Abdallah M. Elgorban, Ling Shing Wong

J. Chem. Phys. 160, 244201 (2024)

https://doi.org/10.1063/5.0213551

Published: June 2024

View article titled, Novel S–N/WO3: Optimization of photocatalytic performance of WO3 by simultaneous existence of S and N in WO3 against MB dye

NARROW

Topics

Comment on “Surface nuclear spin relaxation of ¹⁹⁹Hg,” [J. Chem. Phys. 120, 1511 (2004)]

Electride transition in liquid aluminum under high pressure and high temperature

Accurate DFT simulation of complex functional materials: Synergistic enhancements achieved by SCAN meta-GGA

Interband and intraband transitions, as well as charge mobility in driven two-band model with electron–phonon coupling

Constructing surface oxygen vacancy in the [Bi₂O₂]²⁺ layer defects mediated Bi₂MoO₆ enhanced visible light responsive photocatalytic activity

Rational design of MoS₂/CNT heterostructure with rich S-vacancy for enhanced HER performance

Lifetime mapping using femtosecond time-resolved photoemission electron microscopy

Surface weak ferromagnet coupling induced giant room-temperature spontaneous exchange bias in antiferromagnet Fe₃BO₆ polycrystals

Two-photon absorption in silicon using the real density matrix approach

A prediction of high temperature magnetic coupling in transition metal phthalocyanines

Spin conductances and magnetization production in chiral molecular junctions

First-principles study on pressure-induced superconductivity and structural design on transition metal diborides

First-principles investigation of oxidized Si- and Ge-terminated diamond (100) surfaces

Quantifying carrier density in monolayer MoS₂ by optical spectroscopy

Mixed quantum–classical modeling of exciton–phonon scattering in solids: Application to optical linewidths of monolayer MoS₂

Raman spectroscopy and photoluminescence study of PN junction p-graphene/n-GaAs

Shedding light on evolution of Raman line shape with probing laser power: Light-induced perturbation in electron–phonon coupling

Temperature dependent Raman spectroscopy and sensing performance of 2D black phosphorus

Enhancement of visible light response of TiO₂ photocatalyst by 3D-deposited Ag nanowires and its charge separation mechanism

Novel S–N/WO₃: Optimization of photocatalytic performance of WO₃ by simultaneous existence of S and N in WO₃ against MB dye

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