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関連文献
Charge-transfer interactions between TCNQ and silver clusters Ag20 and Ag13
Jing Chen, Hanyu Zhang, Xianhu Liu, Chengqian Yuan, Meiye Jia, Zhixun Luo, Jiannian Yao
DOI: 10.1039/C5CP06892D
Tuning the charge state of Ag and Au atoms and clusters deposited on oxide surfaces by doping: a DFT study of the adsorption properties of nitrogen- and niobium-doped TiO2 and ZrO2
Philomena Schlexer, Antonio Ruiz Puigdollers, Gianfranco Pacchioni
DOI: 10.1039/C5CP03834K
Structures of seven molybdenum surfaces and their coverage dependent hydrogen adsorption
Tao Wang, Xinxin Tian, Jianguo Wang, Matthias Beller
DOI: 10.1039/C5CP07349A
Molecular dynamics simulations of the atom packing characteristics of three deformed silver nanoparticles at room temperature
DOI: 10.1039/C6CP00188B
Structural transition upon hydrogenation of B20 at different charge states: from tubular to disk-like, and to cage-like
Bing Bai, Hui Bai
DOI: 10.1039/C5CP07731A
Fullerene-based materials for solar cell applications: design of novel acceptors for efficient polymer solar cells – a DFT study
Afshan Mohajeri, Akbar Omidvar
DOI: 10.1039/C5CP02453F
A combined crossed molecular beam and theoretical investigation of the reaction of the meta-tolyl radical with vinylacetylene – toward the formation of methylnaphthalenes
Tao Yang, Lloyd Muzangwa, Ralf I. Kaiser, Adeel Jamal
DOI: 10.1039/C5CP03285G
Predictions of the physicochemical properties of amino acid side chain analogs using molecular simulation
Alauddin Ahmed, Stanley I. Sandler
DOI: 10.1039/C5CP05393E
The effect of sequence on the ionization of guanine in DNA
Rahul Chakraborty, Debashree Ghosh
DOI: 10.1039/C5CP07804K
Collisional excitation of CH(X2Π) by He: new ab initio potential energy surfaces and scattering calculations
Sarantos Marinakis, Indigo Lily Dean, Jacek Kłos, François Lique
DOI: 10.1039/C5CP03696H
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掲載誌
Physical Chemistry Chemical Physics

Physical Chemistry Chemical Physics (PCCP) is an international journal co-owned by 19 physical chemistry and physics societies from around the world. This journal publishes original, cutting-edge research in physical chemistry, chemical physics and biophysical chemistry. To be suitable for publication in PCCP, articles must include significant innovation and/or insight into physical chemistry; this is the most important criterion that reviewers and Editors will judge against when evaluating submissions. The journal has a broad scope and welcomes contributions spanning experiment, theory, computation and data science. Topical coverage includes spectroscopy, dynamics, kinetics, statistical mechanics, thermodynamics, electrochemistry, catalysis, surface science, quantum mechanics, quantum computing and machine learning. Interdisciplinary research areas such as polymers and soft matter, materials, nanoscience, energy, surfaces/interfaces, and biophysical chemistry are welcomed if they demonstrate significant innovation and/or insight into physical chemistry. Joined experimental/theoretical studies are particularly appreciated when complementary and based on up-to-date approaches.











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