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Physical Chemistry Chemical Physics JOURNAL published |
Photolytic splitting of homodimeric quinone-derived oxetanes studied by ultrafast transient absorption spectroscopy and quantum chemistry JOURNAL ARTICLE published 2024 in Physical Chemistry Chemical Physics |
Atomic Insights into the Interaction of N2, CO2, NH3, NO, and NO2 Gas Molecules with the Zn2(V, Nb, Ta)N3 Ternary Nitride Monolayers JOURNAL ARTICLE published 2024 in Physical Chemistry Chemical Physics |
SadNet: a novel multimodal fusion network for protein–ligand binding affinity prediction JOURNAL ARTICLE published 2024 in Physical Chemistry Chemical Physics Research funded by National Natural Science Foundation of China (62272214) | National Key Research and Development Program of China (2020YFA071360) |
Enhanced intramolecular charge transfer and near-infrared fluorescence in 4-dimethylamino-chalcone analogues through extended conjugation: synthesis, photophysical properties, and theoretical modelling JOURNAL ARTICLE published 2024 in Physical Chemistry Chemical Physics Research funded by Sultan Qaboos University (CL/SQU\QU/SCI/24/01,IG/SCI/CHEM/24/05) | Arab-German Young Academy of Sciences and Humanities (01DL16002,01DL20003) |
High-temperature molecular line list of hydroboron monoxide (HBO) JOURNAL ARTICLE published 2024 in Physical Chemistry Chemical Physics Research funded by National Natural Science Foundation of China (52106098,52076123) | Natural Science Foundation of Shandong Province (ZR2021QE021) |
Realization of efficient and selective NO and NO2 detection via surface functionalized h-B2S2 monolayer JOURNAL ARTICLE published 2024 in Physical Chemistry Chemical Physics Research funded by Department of Science and Technology, Ministry of Science and Technology, India (DST/INSPIRE Fellowship/2018/IF180745) |
Optical response and gas sequestration properties of metal cluster supported graphene nanoflakes JOURNAL ARTICLE published 2016 in Physical Chemistry Chemical Physics |
Fullerenol C60(OH)16 prevents amyloid fibrillization of Aβ40 – in vitro and in silico approach JOURNAL ARTICLE published 2016 in Physical Chemistry Chemical Physics |
PCl3–C6H6 heterodimers: evidence for P⋯π phosphorus bonding at low temperatures JOURNAL ARTICLE published 2016 in Physical Chemistry Chemical Physics |
The structure of liquid water beyond the first hydration shell JOURNAL ARTICLE published 2016 in Physical Chemistry Chemical Physics |
Photofragmentation mechanisms in protonated chiral cinchona alkaloids JOURNAL ARTICLE published 2016 in Physical Chemistry Chemical Physics Research funded by Agence Nationale de la Recherche (ANR-14-CE06-0019-03) |
The transport properties of silicon and carbon nanotubes at the atomic scale: a first-principles study JOURNAL ARTICLE published 2016 in Physical Chemistry Chemical Physics Research funded by National Natural Science Foundation of China (21203020,31401201,21403081,21403033) |
A first-principles study of pressure-induced phase transformation in a rare-earth formate framework JOURNAL ARTICLE published 2016 in Physical Chemistry Chemical Physics Research funded by National Natural Science Foundation of China (61138006 and 21571072) |
The reaction current distribution in battery electrode materials revealed by XPS-based state-of-charge mapping JOURNAL ARTICLE published 2016 in Physical Chemistry Chemical Physics Research funded by Office of Science (DESC0001160) |
Nanoporous two-dimensional MoS2 membranes for fast saline solution purification JOURNAL ARTICLE published 2016 in Physical Chemistry Chemical Physics Research funded by National Natural Science Foundation of China (11405146) |
Photoionization of N,N,N′N′-tetramethylbenzidine in chromium silicoaluminophosphate microporous materials JOURNAL ARTICLE published 2001 in Physical Chemistry Chemical Physics |
A theoretical study of the prereaction process of the H···HF van der Waals molecule JOURNAL ARTICLE published 1999 in Physical Chemistry Chemical Physics |
The use of threshold photoelectron–photoion coincidence spectroscopy to probe the spectroscopic and dynamic properties of the valence states of CCl3F+, CCl3H+ and CCl3Br+ JOURNAL ARTICLE published 2000 in Physical Chemistry Chemical Physics |
Adsorption of methanol, formaldehyde and formic acid on the Si(100)-2×1 surface: A computational study JOURNAL ARTICLE published 2001 in Physical Chemistry Chemical Physics |