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Polarization-Resolved Spectral Features and Dielectric Medium Effects in Plexcitonic Systems: Findings from Single-Particle Spectroscopy J. Phys. Chem. C (IF 3.3) Pub Date : 2024-12-28 Mavilakizhakke Puthiyaveetil Ajaykumar, Neenu Joseph, Aswathy Raveendran, Ranguwar Rajendra, Rotti Srinivasamurthy Swathi, K. George Thomas
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Cost-Effective Strategy of Enhancing Machine Learning Potentials by Transfer Learning from a Multicomponent Data Set on ænet-PyTorch J. Phys. Chem. C (IF 3.3) Pub Date : 2024-12-27 An Niza El Aisnada, Kajjana Boonpalit, Robin van der Kruit, Koen M. Draijer, Jon López-Zorrilla, Masahiro Miyauchi, Akira Yamaguchi, Nongnuch Artrith
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Ti3C2Tx MXene Thin Films and Intercalated Species Characterized by IR-to-UV Broadband Ellipsometry J. Phys. Chem. C (IF 3.3) Pub Date : 2024-12-27 Andreas Furchner, Tetiana Parker, Vincent Mauchamp, Simon Hurand, Julian Plaickner, Jörg Rappich, Aline Alencar Emerenciano, Karsten Hinrichs, Yury Gogotsi, Tristan Petit
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Exotic Thermoelectric Properties of Coronene-Cyclobutadienoid Graphene Nanoribbons J. Phys. Chem. C (IF 3.3) Pub Date : 2024-12-27 Chao Yao, Chen Kong, Hui-Feng Feng, Yan Dong, Li Huang, Xian Zhang, Zhongxio. Song, Zhi-Xin Guo
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Radical Intermediates in Photocatalytic Activation of Carboxylic Acids: A Spin Trapping Study J. Phys. Chem. C (IF 3.3) Pub Date : 2024-12-27 Gunik Lee, Riko Maruyama, Kexin Zou, Haifan Huang, Kin-ichi Oyama, Hisao Yoshida, Jun Kumagai
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Enhanced Phase Stability and Oxide-Ion Conductivity in V- and Sr/Ca-Codoped Bi2O3 Ceramics J. Phys. Chem. C (IF 3.3) Pub Date : 2024-12-26 Diksha N. Karmalkar, K. R. Priolkar, K. S. Chikara, A. K. Bera, S. M. Yusuf, Bholanath Pahari
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Kinetic Monte Carlo Approach as a Tool for the Study of Magnetic Hyperthermia Efficiency J. Phys. Chem. C (IF 3.3) Pub Date : 2024-12-26 C. M. Aono, V. R. R. Aquino, A. F. Bakuzis, R. Miotto
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Theoretical Exploration of the Competitive Mechanism for Hydrodehydration and Decarboxylation of 2,5-Furandicarboxylic Acid by Pt1 and Pt3 Supported on Nb2O5 J. Phys. Chem. C (IF 3.3) Pub Date : 2024-12-26 Ting-Hao Liu, Shuai Fu, Jin-Tao Gou, Ming-Hui Zhang, Chang-Wei Hu, Hua-Qing Yang
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Tuning Fluorescence Resonance Energy Transfer in Cadmium Telluride-Diketopyrrolopyrrole Hybrids via Bandgap Engineering J. Phys. Chem. C (IF 3.3) Pub Date : 2024-12-26 Xiaonan Fan, Chenyang Wang, Heyuan Liu, Ruifan Zhang, Wenya Liu, Hantao Sun, Xianyuan Wang, Boce Cui, Yanli Chen, Xiyou Li
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Theoretical Study of InxRuy Alloys for Efficient Electrocatalytic Reduction of Nitrate to Ammonia J. Phys. Chem. C (IF 3.3) Pub Date : 2024-12-26 Qingchao Fang, Md Tarikal Nasir, Dimuthu Wijethunge, Xuxin Kang, Yun Han, Cheng Yan, Anthony P. O’ Mullane, Hanqing Yin, Aijun Du
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Modulating the Electronic Properties of Orthorhombic Mo2C Surfaces with Strain and Defects: Insights from First-Principles Calculations J. Phys. Chem. C (IF 3.3) Pub Date : 2024-12-26 Sourabh Kumar, Gokay Adabasi, Mehmet Z. Baykara, Ashlie Martini
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Thermodynamic Insights into the Acid Strength of Sulfonate Linkers in Confined Space J. Phys. Chem. C (IF 3.3) Pub Date : 2024-12-25 Gourav Shrivastav, Jasmin Kaur, M. Ali Haider
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Direct Measurement of Carrier Distribution in Perovskite by Scanning Capacitance Microscopy J. Phys. Chem. C (IF 3.3) Pub Date : 2024-12-25 Xirui Liu, Xiaoyi Lu, Xiting Lang, Minghui Li, Yangyang Gou, Yongjie Jiang, Junchuan Zhang, Hao Tian, Yueying Zhang, Herui Xi, Chen Chen, Changlei Wang, Chang Liu, Xiangyang Kong, Jichun Ye, Chuanxiao Xiao
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Localized Nanoscale Formation of Vanadyl Porphyrin 2D MOF Nanosheets and Their Optimal Coupling to Lumped Element Superconducting Resonators J. Phys. Chem. C (IF 3.3) Pub Date : 2024-12-25 Ignacio Gimeno, Fernando Luis, Carlos Marcuello, Maria Carmen Pallarés, Anabel Lostao, Marina Calero de Ory, Alicia Gomez, Daniel Granados, Inés Tejedor, Eva Natividad, Ainhoa Urtizberea, Olivier Roubeau
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Atomic Layer Deposition of Platinum on the Oxygen-Pretreated Graphene Surface J. Phys. Chem. C (IF 3.3) Pub Date : 2024-12-25 Lan-Anh T. Le, Huong T. T. Ta, Hao Van Bui, Ngoc Linh Nguyen
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Reverse Spillover Dominating CO Adsorption on Single Cobalt Atoms in Graphene Divacancies J. Phys. Chem. C (IF 3.3) Pub Date : 2024-12-25 Francesco Armillotta, Pardis Naderasli, Valeria Chesnyak, Harald Brune
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Machine Learning-Assisted Screening of Hexagonal 2D van der Waals Bilayers for Photocatalysis J. Phys. Chem. C (IF 3.3) Pub Date : 2024-12-24 Arooba Kanwal, Abdul Jalil, Syed Raza Ali Raza
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Kinetic Separation of Siloxanes in Metal–Organic Frameworks J. Phys. Chem. C (IF 3.3) Pub Date : 2024-12-24 Jia Yuan Chng, David S. Sholl
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17O and 31P Solid-State NMR Investigations of Faceted Indium Oxide Nanomaterials J. Phys. Chem. C (IF 3.3) Pub Date : 2024-12-24 Zhengting Zhang, Jiaqi Wu, Zhonghan Feng, Xiaoli Xia, Juan Wen, Fang Wang, Xiang Ning, Yujie Wen, Xiaokang Ke, Hanxi Guan, Luming Peng
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Fluxional Doping-Si Manipulates Spin Coupling Characteristics in Silicon-Vacancy Defect Nanodiamond J. Phys. Chem. C (IF 3.3) Pub Date : 2024-12-24 Shaofen Yu, Yamin Song, Zhuxiao Li, Yuxiang Bu, Xinyu Song
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Toward Realistic Simulations of Zeolite Catalytic Processes: A Mini Review J. Phys. Chem. C (IF 3.3) Pub Date : 2024-12-24 Lulu Li, Xiaofang Xu, Mao Ye, Zhongmin Liu
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Large-Area Black Phosphorus by Chemical Vapor Transport for Vertical and Lateral Memristor Devices J. Phys. Chem. C (IF 3.3) Pub Date : 2024-12-24 Xi Wan, Yingdi Yu, Xin Wang, Tianao Liu, Mingkang Zhang, EnZi Chen, Kun Chen, Shuting Wang, Feng Shao, Xiaofeng Gu, Jianbin Xu
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Exploring Hydrogen-Bearing Metallic Alloys: Phonon-Mediated Superconductivity in (Zr,Hf)H3 under High Pressure J. Phys. Chem. C (IF 3.3) Pub Date : 2024-12-23 Prutthipong Tsuppayakorn-aek, Wiwittawin Sukmas, Komsilp Kotmool, Wei Luo, Thiti Bovornratanaraks
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Exploring Molecular Motion through an Order–Disorder Transition within the Erythrosiderite Mineral Compound, (NH4)2 [FeCl5(H2O)] J. Phys. Chem. C (IF 3.3) Pub Date : 2024-12-23 Adam Berlie, Hamish Cavaye, Judith Peters
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Energy Transfer for Leaky Surface Plasmon Polaritons in Gold Nanostripes J. Phys. Chem. C (IF 3.3) Pub Date : 2024-12-23 Janak Bhandari, Gregory V. Hartland
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Enhanced Structural and Electrochemical Stability of Li and Mg Co-Doped LiMn2O4 Cathodes for Li-Ion Batteries with a Mg Source from Bischofite J. Phys. Chem. C (IF 3.3) Pub Date : 2024-12-23 Aleksei Llusco, Luis Rojas, Mario Grágeda, Jorge A. Lovera
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Combined Experimental and Theoretical Approach to the Electronic and Magnetic Properties of Cu-Doped LaMnO3 Perovskites J. Phys. Chem. C (IF 3.3) Pub Date : 2024-12-23 Josef M. Gallmetzer, Felix R. S. Purtscher, Jakob Gamper, Asghar Mohammadi, Ralf Feyerherm, Wiebke Riedel, Simon Penner, Thomas S. Hofer
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Electrophilic Substitution as a Mechanism for Ligand Exchange Reactions on Silver Monolayer-Protected Clusters J. Phys. Chem. C (IF 3.3) Pub Date : 2024-12-23 Tharuka Ubayasena, Badri Bhattarai, Bokwon Yoon, Uzi Landman, Terry P. Bigioni
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Size-Dependent Charging Energy Determines the Charge Transport in ZnO Quantum Dot Solids J. Phys. Chem. C (IF 3.3) Pub Date : 2024-12-22 Morteza Shokrani, Dorothea Scheunemann, Clemens Göhler, Martijn Kemerink
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Influence of Dissolved Iron in Solution on MgO Hydroxylation and Carbonation J. Phys. Chem. C (IF 3.3) Pub Date : 2024-12-21 Juliane Weber, Brittany Moseley, Ke Yuan, Barbara R. Evans, Vitalii Starchenko, Elena Tajuelo Rodriguez, Dong Youn Chung, Matthew G. Boebinger, Michael A. McGuire, George Yumnam, Raphael P. Hermann, Lawrence M. Anovitz, Andrew G. Stack
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Electronic Hybridization between Closed-Shell Materials J. Phys. Chem. C (IF 3.3) Pub Date : 2024-12-21 Wen-Xin Xia, Xiao-Huan Lv, Mei-Yan Tian, Yu-Meng Gao, Ke-Xin Hou, Peng-Lai Gong, Chen-Dong Jin, Jiang-Long Wang, Xing-Qiang Shi
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Assessment of Long-Term Degradation of Adsorbents for Direct Air Capture by Ozonolysis J. Phys. Chem. C (IF 3.3) Pub Date : 2024-12-20 Shubham Jamdade, Xuqing Cai, David S. Sholl
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Ultrastable Pt/Zn-Doped-Al2O3 Catalyst for Propane Dehydrogenation J. Phys. Chem. C (IF 3.3) Pub Date : 2024-12-20 Yanan Xing, Bonan Li, Leilei Kang, Yang Su, Xiaoli Pan, Lin Li, Hua Liu, Xiao Yan Liu, Aiqin Wang, Tao Zhang
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Anisotropic Interlayer Force Field for Heterogeneous Interfaces of Graphene and h-BN with Transition Metal Dichalcogenides J. Phys. Chem. C (IF 3.3) Pub Date : 2024-12-20 Wenwu Jiang, Reut Sofer, Xiang Gao, Leeor Kronik, Oded Hod, Michael Urbakh, Wengen Ouyang
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Understanding the Origin of the Redox Potential Shift of Transition Metal in LiFexMn1–xPO4 Cathodes by the Molecular Orbital Theory J. Phys. Chem. C (IF 3.3) Pub Date : 2024-12-20 Zhenming Xu, Yuqiao Jiang, Xiangmin Feng, Ke Wang, Yue Zhou, Mingbo Zheng, Yixi Lin, Yinghui Xia, Zhenhui Liu, Laifa Shen, Yongyao Xia
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Magnesium Ferrite Promoting the Purity of Grown Boron Nitride Nanotubes J. Phys. Chem. C (IF 3.3) Pub Date : 2024-12-20 Xin Chen, Liyun Wu, Kai Zhang, Qian He, Ying Wang, Haoting Niu, WenTao Zheng, Yagang Yao
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Theoretical Study of Controllable Radioactive Xe/Kr Separation on C3N Modulated by Electric Fields J. Phys. Chem. C (IF 3.3) Pub Date : 2024-12-19 Xiang Li, Mingzhu Jin, Wenxi Zhang, Mengnan Qu, Aijun Du, Jianfen Fan, Qiao Sun
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Absence of Anomalous Electron–Phonon Coupling in the Near-Ambient Gap Temperature Renormalization of CsPbBr3 Nanocrystals J. Phys. Chem. C (IF 3.3) Pub Date : 2024-12-19 Shima Fasahat, Benedikt Schäfer, Kai Xu, Nadesh Fiuza-Maneiro, Sergio Gómez-Graña, M. Isabel Alonso, Lakshminarayana Polavarapu, Alejandro R. Goñi
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Influence of Deposition Temperature on Cu-BDC Surface-Anchored Metal–Organic Framework Formation J. Phys. Chem. C (IF 3.3) Pub Date : 2024-12-19 Skylar J. Delozier, Dayton L. Maglich, Katherine E. Coffin, Katherine S. Euston, Catherine M. Mauck, Mary E. Anderson
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Impact of Anions and Water Content on [Li–Al] Layered Double-Hydroxide Stability J. Phys. Chem. C (IF 3.3) Pub Date : 2024-12-19 Christopher Hoban, Natalie Parkinson, K. Jayanthi, M. Parans Paranthaman, Alexandra Navrotsky, Brian F. Woodfield
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Defect-Mediated Crystallization of the Particulate TiO2 Photocatalyst Grown by Atomic Layer Deposition J. Phys. Chem. C (IF 3.3) Pub Date : 2024-12-19 Bela D. Bhuskute, Harri Ali-Löytty, Jesse Saari, Arto Hiltunen, Tero-Petri Ruoko, Turkka Salminen, Mika Valden
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Dominating Role of Carrier Localization over Griffiths Inhomogeneity and Phase Separation on Magnetoresistance in High Entropy Manganites J. Phys. Chem. C (IF 3.3) Pub Date : 2024-12-19 Radhamadhab Das, Sujan Sen, Shreyashi Chowdhury, Sudipa Bhattacharya, Sudisha Mondal, Tapas Kumar Mandal, Arup Gayen, Vasundhara Mutta, Md. Motin Seikh
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Multidimensional Catalysis Data Representation for Designing Oxidative Coupling of Methane Catalysts J. Phys. Chem. C (IF 3.3) Pub Date : 2024-12-19 Yoshiki Hasukawa, Fernando Garcia-Escobar, Keisuke Takahashi, Lauren Takahashi
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Bimetallic Pd–Rh Nanoparticles Supported on Co3O4(111): Atomic Ordering and Stability J. Phys. Chem. C (IF 3.3) Pub Date : 2024-12-19 Alexander Simanenko, Jan Škvára, Pankaj Kumar Samal, Lukáš Fusek, Maximilian Kastenmeier, Michal Ronovský, Tomáš Skála, Nataliya Tsud, Sascha Mehl, Viktor Johánek, Josef Mysliveček, Olaf Brummel, Yaroslava Lykhach, Jörg Libuda
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Oxidation of Silicon Carbide with Atomic Oxygen through the Passive-to-Active Transition J. Phys. Chem. C (IF 3.3) Pub Date : 2024-12-19 David Z. Chen, Chenbiao Xu, Vanessa J. Murray, Pedro Recio, Chloe Miossec, Nadia Balucani, Piergiorgio Casavecchia, Timothy K. Minton
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Effect of Internal Electron Donors on Butadiene Polymerization Catalyzed by the TiCl4/MgCl2 Ziegler–Natta Catalyst J. Phys. Chem. C (IF 3.3) Pub Date : 2024-12-19 RunChuan Zhou, Ang Zhao, Jian Liu, AiHua He, Xia Yang
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Putting the Incoming/Outgoing Correlation (INOUTCO) Ion Imaging Surface Scattering Technique to the Test in O Atom Scattering from Graphite J. Phys. Chem. C (IF 3.3) Pub Date : 2024-12-19 Zibo Zhao, Ximei Yang, Yingqi Wang, Jiamei Quan, Jiami Zhou, Song Gao, Xia Zhou, Gongkui Cheng, Dezhi Qiao, Jiayue Yang, Weiqing Zhang, Xueming Yang, Hua Guo, G. Barratt Park
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Supported Lipid Bilayers as Stochastic Conveyor Belt for Delivery to the Near Field of Nanoscopic Structures J. Phys. Chem. C (IF 3.3) Pub Date : 2024-12-19 Yazgan Tuna, Vahid Sandoghdar
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Effect of the Ti2CTx (Tx = O, OH, and H) Functionalization on the Formation of (TiO2)5/Ti2CTx Composites J. Phys. Chem. C (IF 3.3) Pub Date : 2024-12-19 Néstor García-Romeral, Ángel Morales-García, Francesc Viñes
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Cold-Welding Mechanism and Tensile Behaviors of Cu–Al Nanowires: A Molecular Dynamics Simulation J. Phys. Chem. C (IF 3.3) Pub Date : 2024-12-19 Zhiheng Guo, Dong Chen, Lizhi Li, Danting Zheng, Haosheng Zhao, Zuncheng Zhao
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Investigating the Influence of the Spacer Length on Anion-Exchange Membrane Properties Using a Reactive Molecular Model J. Phys. Chem. C (IF 3.3) Pub Date : 2024-12-19 Thibaut Flottat, Benoit Latour, Florent Goujon, Patrice Hauret, Patrice Malfreyt
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Vibrational and Structural Properties of PTCDA on Ag(110) J. Phys. Chem. C (IF 3.3) Pub Date : 2024-12-19 R. Priya, Peter Jakob
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Mechanical Nonlinearity and Microscale Deformation of Gas Diffusion Layer in Proton Exchange Membrane Fuel Cell J. Phys. Chem. C (IF 3.3) Pub Date : 2024-12-19 Kai Lu, Shunbo Lan, Liang An, Rui Lin
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Accurate Singlet–Triplet Excited States Energy Gap Can Be Mastered by Time-Dependent Density Functional Theory Calculations Based on a Dielectric-Screened Range-Separated Hybrid Functional J. Phys. Chem. C (IF 3.3) Pub Date : 2024-12-18 Roshan Khatri, Barry D. Dunietz
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Uncover Chemical Processes for Silica Surfaces Exposed to Atomic Oxygen Using ReaxFF Reactive Molecular Dynamics J. Phys. Chem. C (IF 3.3) Pub Date : 2024-12-18 Xinbin Ye, Shiwei Hu, Guan Zhang, Yabin Yan, Quanhua Sun, Yuan Hu
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Simultaneous Superconducting and Topological Properties in Mg–Li Electrides at High Pressures J. Phys. Chem. C (IF 3.3) Pub Date : 2024-12-18 Dan Wang, Hongxing Song, Qidong Hao, Guangfa Yang, Hao Wang, Leilei Zhang, Ying Chen, Xiangrong Chen, Huayun Geng
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Hydration Processes of the Proton-Conducting Hexagonal Perovskites Ba7In6–xYxAl2O19 J. Phys. Chem. C (IF 3.3) Pub Date : 2024-12-18 Roman D. Andreev, Irina E. Animitsa
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Influence of the Deviation from Stoichiometry on Transport Properties of Titanium Oxides Thin Films J. Phys. Chem. C (IF 3.3) Pub Date : 2024-12-18 K. Kulinowski, M. Radecka, B. J. Spisak
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Theoretical Insights on the Synergistic Effect of Dual Metal Sites Supported on MgO(100) Promoting the Hydrogenation Reaction J. Phys. Chem. C (IF 3.3) Pub Date : 2024-12-18 Ruifang Xue, Fang-Fang Wang, De-Li Chen, Fumin Zhang, Weidong Zhu
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One Pot Synthesis of Cyan Emitting CdZnSSe Quantum Dots for Human Centric Lighting J. Phys. Chem. C (IF 3.3) Pub Date : 2024-12-18 Abraham J. Jordan, Zhuolei Zhang, Ellie Bennett, Leslie Guadalupe Castro, David Jingbo Han, Iva Rreza, Ayelet Teitelboim, Brian Theobald, Bereket Zekarias, Emory M. Chan, Jonathan S. Owen