RSC – Phys. Chem. Chem. Phys. latest articles- Surface diffusion of phosphorus on Si(100) after PBr3 adsorption October 16, 2025Phys. Chem. Chem. Phys., 2025, Accepted ManuscriptDOI: 10.1039/D5CP03294F, PaperTatiana Pavlova, Vladimir ShevlyugaPhosphorus diffusion on a Si(100) surface was studied using scanning tunneling microscopy (STM) at temperatures of 77 and 300 K. The phosphorus source utilized was the PBr3 molecule, which fully...The content of this RSS Feed (c) The Royal Society of ChemistryTatiana Pavlova
- Ion transport and structural properties of highly concentrated organogel electrolytes based on Tetra-arm PEG networks October 16, 2025Phys. Chem. Chem. Phys., 2025, Accepted ManuscriptDOI: 10.1039/D5CP03562G, PaperYuna Deguchi, Yuta Yasui, Tomoya Tashiro, Masaru Matsugami, Saki Sawayama, Kenta FujiiWe report a new class of poly(ethylene glycol) (PEG)-based gel electrolytes formed via salting-in polymer dissolution in highly concentrated LiFSA/AN electrolytes (FSA: bis(fluorosulfonyl)amide; AN: acetonitrile). We demonstrated that PEG exhibits...The content of this RSS Feed (c) […]Yuna Deguchi
- Periodic burst-like photochemical bond splitting in metal carbonyls and cyclohexadiene October 16, 2025Phys. Chem. Chem. Phys., 2025, Accepted ManuscriptDOI: 10.1039/D5CP02773J, Perspective Open Access   This article is licensed under a Creative Commons Attribution 3.0 Unported Licence.Werner FußRecently, Schori et al. (Nature Comm. 16(2025)4767) observed by time-resolved X-ray diffraction of Fe(CO)5, excited at 267 nm, a burst-like CO elimination, which was synchronized with a Fe–CO stretch vibration...The content […]Werner Fuß
- First-Principles Investigation of the Terahertz Absorption Spectrum and Thermodynamic Properties of Methane Hydrate October 16, 2025Phys. Chem. Chem. Phys., 2025, Accepted ManuscriptDOI: 10.1039/D5CP02593A, PaperYuchao Li, Chenglong Wang, Xiang Hou, Fangze Deng, Zhihua Han, Yansheng Shao, Keke Cheng, Ke Ma, Yumeng Ma, Huifang Ma, Huiyun Zhang, Yuping ZhangMethane hydrates are crystalline compounds widely found in seafloor sediments and permafrost regions, playing a significant role in energy storage and climate dynamics. The […]Yuchao Li
- Microwave Absorption of Multi-Component Co x Ni y O z Decorated 3D-Honeycomb Ordered Mesoporous Carbon Nanospheres Enhanced by Impedance Matching October 16, 2025Phys. Chem. Chem. Phys., 2025, Accepted ManuscriptDOI: 10.1039/D5CP03168K, PaperQicheng Zhu, Li Xu, Yun Zhou, Yanli NanMicrowave absorbing materials are essential for mitigating electromagnetic pollution. This study presents novel nitrogen-doped 3D-honeycomb-like ordered mesoporous carbon nanospheres (MCN) synthesized via aniline polymerization on silica templates, followed by the...The content of this RSS Feed (c) The Royal Society of […]Qicheng Zhu
- Electric-field-induced magnetic phase transition in (Hf2/3Fe1/3)2COF October 16, 2025Phys. Chem. Chem. Phys., 2025, Accepted ManuscriptDOI: 10.1039/D5CP02104A, PaperMingyu Zhao, Yanan TangFerromagnetism breaks time-reversal symmetry, while ferroelectricity breaks spatial-inversion symmetry. Their fundamental origins are different. Thus, there are few materials with intrinsic magnetoelectric coupling. In this work, a 2D Janus in-plane ordered magnetic MXene structure, (Hf₂/₃Fe₁/₃)₂COF, has been...The content of this RSS Feed (c) The Royal Society of ChemistryMingyu Zhao
- Rotational excitation of fulminic acid (HCNO) in collisions with molecular hydrogen October 16, 2025Phys. Chem. Chem. Phys., 2025, Accepted ManuscriptDOI: 10.1039/D5CP03326H, Paper Open Access   This article is licensed under a Creative Commons Attribution-NonCommercial 3.0 Unported Licence.Paul J. DagdigianIntegral cross sections and rate coefficients for the rotational excitation of fulminic acid (HCNO) induced by collisions with molecular hydrogen are reported in this work. These quantities were derived through...The […]Paul J. Dagdigian
- Cation distribution and its magnetic implications in gadolinium–iron garnets for an enhanced control of compensation temperature October 15, 2025Phys. Chem. Chem. Phys., 2025, Advance ArticleDOI: 10.1039/D5CP02696B, Communication Open Access   This article is licensed under a Creative Commons Attribution-NonCommercial 3.0 Unported Licence.Cristina Bartha, Claudiu Locovei, Andrei Alexandru-Dinu, Cezar Comanescu, Mihai Alexandru Grigoroscuta, Andrei Kuncser, Nicusor Iacob, Magda Galatanu, Aurel Leca, Petre Badica, Victor KuncserResults highlight magnetic structures of the garnets prepared by two […]Cristina Bartha
- Enhanced configurational sampling methods reveal the importance of molecular stiffness for clustering of oxygenated organic molecules October 15, 2025Phys. Chem. Chem. Phys., 2025, Accepted ManuscriptDOI: 10.1039/D5CP01931A, Paper Open Access   This article is licensed under a Creative Commons Attribution 3.0 Unported Licence.Jaakko Kähärä, Lauri Franzon, Stephen Ingram, Nanna Myllys, Theo Kurtén, Hanna VehkamäkiOxygenated organic molecules (OOMs), formed in the atmosphere by oxidation of volatile organic compounds, have been speculated to take part in […]Jaakko Kähärä
- Structural stability, electrical and optical properties of chalcogen (O, S, and Te) doped tetragonal ZnSe monolayers under high pressure October 15, 2025Phys. Chem. Chem. Phys., 2025, Accepted ManuscriptDOI: 10.1039/D5CP00329F, PaperRunze Tian, Tao Liu, Yuxuan Huang, Shixia WangIn this paper, the structural, electrical and optical properties of pure tetragonal ZnSe monolayers and chalcogen doped ZnSe monolayers have been investigated for changes under pressure based on the first-principles...The content of this RSS Feed (c) The Royal Society of […]Runze Tian
- Interfacial Schottky barrier modulation in Ti3C2/B2S2 heterostructures by surface functionalization and strain engineering October 15, 2025Phys. Chem. Chem. Phys., 2025, Accepted ManuscriptDOI: 10.1039/D5CP02396C, PaperLin Zhu, Yu Ai, Lei Liao, Ali Zeng ShahzadThe interfacial resistance between metals and semiconductors critically effects device performance. To gain a deeper understanding of interfacial properties and enhance device functionality, we employ first-principles calculations to explore the...The content of this RSS Feed (c) The Royal Society […]Lin Zhu
- Assessment of Image-Derived Fractal Dimension for Diffusion-Controlled Periodically Precipitating Bands in a One-Dimensional Configuration October 15, 2025Phys. Chem. Chem. Phys., 2025, Accepted ManuscriptDOI: 10.1039/D5CP03015C, PaperSunil D. Kulkarni, Prasad Walimbe, Vrushabh Salve, Akshay Dimble, Pratik Dahiwadkar, Preeti KulkarniPeriodic deposition of a precipitate in a test tube, formed during a suitable chemical reaction under a non-equilibrium regime, is known as Liesegang bands or patterns. Periodicity of a Liesegang...The content of this RSS Feed […]Sunil D. Kulkarni
- Single Photon Photoelectron Elliptical Dichroism of Amino Acid Anions October 15, 2025Phys. Chem. Chem. Phys., 2025, Accepted ManuscriptDOI: 10.1039/D5CP03324A, Paper Open Access   This article is licensed under a Creative Commons Attribution 3.0 Unported Licence.Jon Henrik Both, Karl-Michael WeitzelSingle photon photoelectron elliptical dichroism (PEELD) has been investigated in the photodetachment of electrosprayed amino acid anions. As analytes tryptophan (Trp) and phenylalanine (Phe) have been studied. For […]Jon Henrik Both
- Prediction of Henry’s law constants for CO2 and CH4 in levulinic acid via different Monte Carlo approaches October 15, 2025Phys. Chem. Chem. Phys., 2025, Accepted ManuscriptDOI: 10.1039/D5CP02630J, PaperPrasil Kapadiya, Jhumpa AdhikariHenry’s law constants of CO2 and CH4 in levulinic acid are predicted at 313.15 K and 101.325 kPa. Widom test particle insertion method (which is based on excess chemical potential...The content of this RSS Feed (c) The Royal Society of ChemistryPrasil Kapadiya
- Structure, spectra, and intracluster chemistry of gasphase platinum nitrosyl ion-molecule complexes October 15, 2025Phys. Chem. Chem. Phys., 2025, Accepted ManuscriptDOI: 10.1039/D5CP03460D, Paper Open Access   This article is licensed under a Creative Commons Attribution 3.0 Unported Licence.Philip Pearcy, Edward I Brewer, Gabriele Meizyte, Scott Harrington, Matthew Doll, Peter Daniel Watson, Christian Thrane Haakansson, Stuart R MackenzieThe structures of gas-phase platinum -nitrosyl ion-molecule complexes, [Pt(NO) n ] + (n […]Philip Pearcy
- Photoswitchable Organic Magnetic Materials October 15, 2025Phys. Chem. Chem. Phys., 2025, Accepted ManuscriptDOI: 10.1039/D5CP02347E, Review ArticlePalash Jana, Sheelbhadra Chatterjee, Subhajit BandyopadhyayControlling magnetism with molecular spin state using external stimuli has a wide range of applications in spintronics, information technology, data storage, and quantum computations. Due to their weak spin-orbit coupling...The content of this RSS Feed (c) The Royal Society of ChemistryPalash Jana
- Phase Engineering of 2D X2C Monolayers: Insights into Metal-Semiconductor Transitions and Multifunctional Applications October 15, 2025Phys. Chem. Chem. Phys., 2025, Accepted ManuscriptDOI: 10.1039/D5CP03127C, PaperClaudia Pereyra, Ricardo Faccio, Federic Iribarne, Andrés Camilo García Castro, Mauricio Vega-Teijido, Marc E SegoviaIn pursuit for advanced materials with potential to invigorate next-generation multifunctional electronic devices, we focus our investigation on a novel class of two-dimensional (2D) binary com- pounds derived from group...The content of this […]Claudia Pereyra
- SD Aromaticity Index: A new assessment of aromaticity based on Ramsey Spin Dipolar contribution to NMR spin-spin coupling constant October 15, 2025Phys. Chem. Chem. Phys., 2025, Accepted ManuscriptDOI: 10.1039/D5CP02867A, PaperM. Natalia C. Zarycz, M. Ayelén Schiel, Hector A. Baldoni, Ricardo D. EnrizAromaticity remains one of the most fundamental yet elusive concepts in chemistry, as no single observable can directly quantify it. In this work, we introduce the Spin–Dipolar Aromaticity Index (SDAI),...The content of this RSS Feed […]M. Natalia C. Zarycz
- Light-induced photoluminescence enhancement in semiconductor nanomaterials: mechanisms and influencing factors October 14, 2025Phys. Chem. Chem. Phys., 2025, Advance ArticleDOI: 10.1039/D5CP02328A, Review ArticlePan Liang, Zhijun Liu, Tianqing Jia, Zhenrong Sun, Rongrong Hu, Donghai FengThis review comprehensively summarizes the factors contributing to light irradiation-induced photoluminescence enhancement in semiconductor nanomaterials.To cite this article before page numbers are assigned, use the DOI form of citation above.The content of this RSS Feed […]Pan Liang
- Hydrogen storage performance of TPO-Graphene system: first-principles calculations October 14, 2025Phys. Chem. Chem. Phys., 2025, Accepted ManuscriptDOI: 10.1039/D5CP02818C, PaperLai Xu, Yuhong Chen, Kongyang Zhao, Jiaxiu Li, Ruifang Gao, Ruonan FengAmong the many forms of graphene and its derivatives, TPO-Graphene (TPOG) exhibits good thermodynamic, mechanical stability and uniform pore size, making it a promising candidate for hydrogen storage. In this...The content of this RSS Feed (c) […]Lai Xu
- Surface diffusion of phosphorus on Si(100) after PBr3 adsorption October 16, 2025
