RSC – Phys. Chem. Chem. Phys. latest articles- Atomic-scale simulation of Al/AlCu intermetallic compounds interfacial mechanical properties August 26, 2025Phys. Chem. Chem. Phys., 2025, Accepted ManuscriptDOI: 10.1039/D5CP02415C, PaperXue Fengning, Wei-Dong Wu, Jian-Li Shao, Pei Wang, Zhiqiang Hu, Yong-Chao WuThe dynamic evolution and the mechanical properties of the Al-Cu interfacial microstructure are of great scientific and technological significance. This study investigated the mechanical properties of Al/AlCu IMC (intermetallic compounds,...The content of this RSS Feed (c) […]Xue Fengning
- Comment on “Experimental support for the model of Bray–Liebhafsky oscillatory reaction based on the heterogeneous effects” by I. N. Bubanja, A. F. Taylor and D. Stanisavljev, Phys. Chem. Chem. Phys., 2024, 26, 24975 August 26, 2025Phys. Chem. Chem. Phys., 2025, Advance ArticleDOI: 10.1039/D5CP00355E, CommentGuy SchmitzW. C. Bray had discovered oscillations in homogeneous solutions.To cite this article before page numbers are assigned, use the DOI form of citation above.The content of this RSS Feed (c) The Royal Society of ChemistryGuy Schmitz
- Reply to the ‘Comment on “Experimental support for the model of Bray–Liebhafsky oscillatory reaction based on the heterogeneous effects”’ by G. Schmitz, Phys. Chem. Chem. Phys., 2025, DOI: 10.1039/D5CP00355E August 26, 2025Phys. Chem. Chem. Phys., 2025, Advance ArticleDOI: 10.1039/D5CP01561H, CommentItana Nuša Bubanja, Annette Fiona Taylor, Dragomir StanisavljevPeriodic gas evolution accompanying oscillatory dynamics of the Bray–Liebhafsky reaction.To cite this article before page numbers are assigned, use the DOI form of citation above.The content of this RSS Feed (c) The Royal Society of ChemistryItana Nuša Bubanja
- Nuclear quantum effects on intramolecular hydrogen bonds and backbone structures in biuret analogues August 26, 2025Phys. Chem. Chem. Phys., 2025, Advance ArticleDOI: 10.1039/D5CP02587G, PaperKotomi Nishikawa, Hikaru Tanaka, Kazuaki Kuwahata, Masanori Tachikawa, Taro UdagawaPath integral molecular dynamics simulations were employed to investigate intramolecular hydrogen bonds in biuret analogues. The results indicate that the structural fluctuations originate from the quantum effects of the heavy nuclei in the backbone.To cite this article before […]Kotomi Nishikawa
- Partition constants of alcohols and surfactants in mixed alcohol/10-carbon dimeric amphiphile aggregates from NMR-diffusion experiments August 25, 2025Phys. Chem. Chem. Phys., 2025, Advance ArticleDOI: 10.1039/D5CP01361E, Paper Open Access   This article is licensed under a Creative Commons Attribution 3.0 Unported Licence.Ahmed A. Elgendy, Brooke A. Morris, Pratap Bahadur, Olivia M. Singer, Liah D. Christie, Robert D. Singer, D. Gerrard MarangoniStacked 1H NMR spectra for 6 μL of 1-butanol in 50 mg mL−1 […]Ahmed A. Elgendy
- The Kick Inside: Time-resolved mechanistic insights into the DUV-driven interconversion of pyrazole to imidazole August 25, 2025Phys. Chem. Chem. Phys., 2025, Accepted ManuscriptDOI: 10.1039/D5CP02684A, Paper Open Access   This article is licensed under a Creative Commons Attribution 3.0 Unported Licence.Derri J Hughes, Wei Bo Ng, Richard T Chapman, George Healing, Michael A Parkes, Jennifer Rigden, Oliver J Smith, Emma Springate, James Thompson, Tiffany Walmsley, Joanne Woodhouse, Russell S MinnsThe interconversion of […]Derri J Hughes
- Quantifying Polycrystallinity Effects on Skyrmion Dynamics and Device Performance August 25, 2025Phys. Chem. Chem. Phys., 2025, Accepted ManuscriptDOI: 10.1039/D5CP01730K, Paper Open Access   This article is licensed under a Creative Commons Attribution-NonCommercial 3.0 Unported Licence.Ahmet Bahadır Trabzon, Arash Mousavi Cheghabouri, Mehmet Cengiz OnbasliSkyrmion devices offer low-power spintronic functionalities, but modeling multi-crystalline magnetic regions is crucial as these regions may completely hinder skyrmion dynamics, pinning behavior, and […]Ahmet Bahadır Trabzon
- Decoupling three-dimensional rotational diffusion of anisotropic nanoparticles using small-angle approximation August 25, 2025Phys. Chem. Chem. Phys., 2025, Advance ArticleDOI: 10.1039/D5CP02808F, PaperJia Zhang, Jiuling Wang, Hai-Xing Wang, Ruo-Yu DongAccurately characterizing the three-dimensional rotational dynamics of anisotropic nanoparticles remains challenging, as experimental techniques and conventional simulation methods often lack the resolution to capture intricate rotational details.To cite this article before page numbers are assigned, use the DOI form of […]Jia Zhang
- NO2 Reduction to HONO by Small α-Hydroxycarbonyls: A Laboratory Investigation in Relevance to Nighttime Production of Atmospheric HONO August 25, 2025Phys. Chem. Chem. Phys., 2025, Accepted ManuscriptDOI: 10.1039/D5CP01520K, PaperSubhasis Mandal, Rinjini Saha, Tapas ChakrabortyThis report presents a gas-phase experimental study on the reduction of NO2 (nitrogen dioxide) to HONO (nitrous acid) by two atmospherically significant volatile organic compounds, glycolaldehyde (Gla) and hydroxyacetone (HAc)...The content of this RSS Feed (c) The Royal Society of ChemistrySubhasis Mandal
- Deciphering Potential-Dependent Oxygen Reduction Kinetics in Spinel Manganese Ferrite August 25, 2025Phys. Chem. Chem. Phys., 2025, Accepted ManuscriptDOI: 10.1039/D5CP01854D, PaperJunxiang Wang, Zhaoyi Jiang, Jingwen Wei, Ye ZhouAccurate evaluation of oxygen reduction reaction (ORR) catalysts, especially transition metal oxides, requires careful control of testing parameters. Here, we report a potential-window-dependent ORR activity for spinel manganese ferrite (MnFe2O4)....The content of this RSS Feed (c) The Royal Society of […]Junxiang Wang
- Structural characterization of cyclodextrin and maltodextrin alkali-metal coordination via ion mobility-mass spectrometry and computational modeling August 25, 2025Phys. Chem. Chem. Phys., 2025, Advance ArticleDOI: 10.1039/D5CP01748C, Paper Open Access   This article is licensed under a Creative Commons Attribution-NonCommercial 3.0 Unported Licence.Hawkins S. Shepard, Emanuel Zlibut, Jody C. May, Benjamin K. Blakley, John A. McLeanStructurally-selective ion mobility-mass spectrometry and complementary computational modeling were implemented to probe the gas-phase conformations of cyclodextrin and maltodextrin […]Hawkins S. Shepard
- Stratified patterns from evaporating colloidal dispersions containing binary particles August 25, 2025Phys. Chem. Chem. Phys., 2025, Advance ArticleDOI: 10.1039/D5CP01284H, PaperLogesh Kumar Pandurangan, Janaki Vembu MurugesanStratifying particles based on their size, coupled with evaporation-driven self-assembly, is an energy-efficient path to achieve particle segregation from an engineering and scientific perspective.To cite this article before page numbers are assigned, use the DOI form of citation above.The content of this […]Logesh Kumar Pandurangan
- Nanoparticle-assisted dynamic nuclear polarization in liquids August 25, 2025Phys. Chem. Chem. Phys., 2025, Advance ArticleDOI: 10.1039/D5CP02465J, Paper Open Access   This article is licensed under a Creative Commons Attribution-NonCommercial 3.0 Unported Licence.Beatrice Bernadette Mascitti, Giordano Zanoni, Alex van der Ham, Luming Yang, Lorenzo Franco, Fabrizio Mancin, Federico Rastrelli, Tomas OrlandoGold nanoparticles, protected with a mix of radical-bearing thiols and organic thiols tailored for […]Beatrice Bernadette Mascitti
- Mind the gaps: what the STGABS27 set can teach about second-order excited state methods, solvent models, and charge transfer August 25, 2025Phys. Chem. Chem. Phys., 2025, Advance ArticleDOI: 10.1039/D5CP02144H, PaperThomas Froitzheim, Christof Hättig, Jan-Michael MewesCharge-transfer (CT) states are ubiquitous in modern organic electronics, yet their accurate theoretical description poses a challenge for common excited state methods – even for correlated wave-function theory with state-of-the-art solvent models.To cite this article before page numbers are assigned, use the […]Thomas Froitzheim
- A transition metal (Ti, V, and Mn)-decorated CrS2 monolayer as a propitious gas scavenger for SF6 decomposition remnants: acumen from density functional theory simulations August 25, 2025Phys. Chem. Chem. Phys., 2025, Advance ArticleDOI: 10.1039/D5CP01801C, Paper Sonam, Neetu GoelThe present study, based on the first-principles calculations, reveals the gas-sensitive properties of the four SF6 decomposition gases (H2S, SO2, SO2F2, and SOF2) over the pristine and TM (Ti, V, and Mn) decoarted CrS2 monolayer at the quantum level.To cite this article before page […]Sonam
- Stochastic Model Analysis of Luminescence Switching in Hybrid Systems of CdSe/CdS Quantum Dots − Spiropyran Molecular Photoswitches August 24, 2025Phys. Chem. Chem. Phys., 2025, Accepted ManuscriptDOI: 10.1039/D5CP02103K, PaperSho Shishido, Moe Yamamoto, Daichi Eguchi, Naoto TamaiHybrid systems (HSs) of quantum dots (QDs) and molecular photoswitches exhibit luminescence switching of QDs based on energy transfer, and have garnered attention for their potential applications in sensors and...The content of this RSS Feed (c) The Royal Society of […]Sho Shishido
- Exploring excited-state proton transfer reactions in isothiazologuanosine, an isofunctional fluorescent analogue of guanosine August 24, 2025Phys. Chem. Chem. Phys., 2025, Accepted ManuscriptDOI: 10.1039/D5CP02642C, Paper Open Access   This article is licensed under a Creative Commons Attribution 3.0 Unported Licence.Olha Tkach, Lara Martinez-Fernandez, Atzin Esmeralda Ruiz-Lera, Nicolas Humbert, Ludovic Richert, Dmytro Dziuba, Elisa Bombarda, Aurélie Bourderioux, Fabien Hanser, Pascal Didier, Yitzhak Tor, Roberto Improta, Jérémie Léonard, Yves MelyTo fully exploit the […]Olha Tkach
- A Fast Electrochemical Quartz Crystal Microbalance (EQCM) Evidences the Presence of Nanobubbles in Alkaline Water Splitting August 24, 2025Phys. Chem. Chem. Phys., 2025, Accepted ManuscriptDOI: 10.1039/D5CP02691A, PaperChristian Leppin, Arne Langhoff, Diethelm JohannsmannA fast electrochemical quartz crystal microbalance with dissipation monitoring (EQCM-D) was used to study the formation of hydrogen bubbles at a cathode during water splitting. Dif-ferent metal surfaces behaved similarly....The content of this RSS Feed (c) The Royal Society of ChemistryChristian Leppin
- Photophysical, thermodynamic and molecular docking studies on the comparative binding interaction of biosynthesized silver nanoparticles with homologous serum proteins: a comprehensive analysis of the interaction mechanisms at both molecular and nanoscale levels August 24, 2025Phys. Chem. Chem. Phys., 2025, Accepted ManuscriptDOI: 10.1039/D5CP02203G, PaperAmar Ghosh, Himal Das, Panneerselvam Murusegan, Manorama Ghosal, Rapti Goswami, Luciano T. Costa, Dulal Senapati, Ujjal Kumar Sur, Suman DasThe comprehensive and systematic study of nanoparticle-protein interactions including the formation of protein corona are essential for the rational design and safe implementation of nanomaterials in various biomedical […]Amar Ghosh
- Integrating intrinsic lightweight, superhard, and magnetic properties in 3D covalent fullerene C24 networks: a first-principles study† August 24, 2025Phys. Chem. Chem. Phys., 2025, Accepted ManuscriptDOI: 10.1039/D5CP02232K, PaperHaoyu Liu, Adili Kuerban, Saierjiang Bieerdemulati, Haiping Wu, Erjun Kan, Yan QianMultifunctional materials that simultaneously possess intrinsic magnetic and superhard properties, particularly those composed of light elements, have a wide range of applications in advanced sensors, shielding, durable devices, and other...The content of this RSS Feed (c) […]Haoyu Liu
- Atomic-scale simulation of Al/AlCu intermetallic compounds interfacial mechanical properties August 26, 2025
