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Photodissociation of medium-sized argon cluster cations in the visible region
Phys. Chem. Chem. Phys., 2015, Advance ArticleDOI: 10.1039/C5CP05257B, PaperMartin Stachon, Ales Vitek, Rene KalusSemiclassical methods for non-adiabatic dynamics simulations, based on a semiempirical...
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Structural instability and mechanical properties of MoS2 toroidal nanostructures
Phys. Chem. Chem. Phys., 2015, Advance ArticleDOI: 10.1039/C5CP05435D, PaperJianyang Wu, Gaosheng Nie, Jun Xu, Jianying He, Qingchi Xu, Zhiliang ZhangClassic molecular dynamics (MD) simulation of...
View ArticleExploring the Role of the 3-Center-4-Electron Bond in Hypervalent [small...
Phys. Chem. Chem. Phys., 2015, Accepted ManuscriptDOI: 10.1039/C5CP05343A, PaperHalua Pinto de Magalhaes, Hans Peter Luthi, Patrick BultinckHypervalent iodine compounds, in particular [small...
View Article[sigma]-Aromatic Cyclic M3+ (M = Cu, Ag, Au) Clusters and their Complexation...
Phys. Chem. Chem. Phys., 2015, Accepted ManuscriptDOI: 10.1039/C5CP06282A, PaperPratim K. Chattaraj, Sudip Pan, Ranajit Saha, Subhajit MandalThe [sigma]-aromaticity of M3+ (M = Cu, Ag, Au) is analyzed...
View ArticleEffects of Biradical Deuteration on the Performance of DNP: Towards Better...
Phys. Chem. Chem. Phys., 2015, Accepted ManuscriptDOI: 10.1039/C5CP06505D, CommunicationFrederic A Perras, Regina R Reinig, Igor Ivan Slowing, Aaron D Sadow, Marek PruskiWe study the effects of the...
View ArticleZnO Modified ZSM-5 and Y Zeolites Fabricated by Atomic Layer Deposition for...
Phys. Chem. Chem. Phys., 2015, Accepted ManuscriptDOI: 10.1039/C5CP05043J, PaperTing Gong, Lijun Qin, Jian Lu, Hao FengZnO modified ZSM-5 and Y zeolites are synthesized by performing atomic layer...
View ArticleBenzodi(pyridothiophene)：A novel acceptor unit for application in the A1-A-A1...
Phys. Chem. Chem. Phys., 2015, Accepted ManuscriptDOI: 10.1039/C5CP05474E, Paperjianhua Chen, Manjun Xiao, linrui Duan, Qiong Wang, Hua Tan, ning Su, Yu Liu, Renqiang Yang, Weiguo ZhuA series of novel...
View ArticleTheoretical studies of energetics and binding isotope effects of binding a...
Phys. Chem. Chem. Phys., 2015, Accepted ManuscriptDOI: 10.1039/C5CP06050H, PaperAgnieszka Krzeminska, Katarzyna Swiderek, Piotr PanethUnderstanding of protein-ligands interactions is crucial for...
View ArticlePNIPAmx-PPO36-PNIPAmx Thermo-sensitive Triblock Copolymers: Chain...
Phys. Chem. Chem. Phys., 2015, Accepted ManuscriptDOI: 10.1039/C5CP06079F, PaperJianyuan Li, Zhijun Zhang, Xianjing Zhou, Tongquan Chen, Jingjing Nie, Binyang DuThe chain conformations and adsorption...
View ArticleSurface Treatment by Binary Solvents Inducing Crystallization of Small...
Phys. Chem. Chem. Phys., 2015, Accepted ManuscriptDOI: 10.1039/C5CP05644F, PaperYiwang Chen, Weihua Zhou, Yuanpeng Xie, Xiaotian Hu, Lin Zhang, Xiangchuan Meng, Yong Zhang, Wei MaThe surface treatment...
View ArticleMicromechanical Measurements of the Effect of Surfactants on Cyclopentane...
Phys. Chem. Chem. Phys., 2015, Accepted ManuscriptDOI: 10.1039/C5CP06071K, PaperErika Brown, Carolyn Ann KohInvestigating the effect of surfactants on clathrate hydrate growth and morphology,...
View ArticleStructural, electronic, magnetic and chemical properties of B-, C- and...
Phys. Chem. Chem. Phys., 2015, Accepted ManuscriptDOI: 10.1039/C5CP05831G, PaperIgor A Pasti, Natalia V SkorodumovaDoping of simple oxide materials can give rise to new exciting physical and chemical...
View ArticleAccess to Aliphatic Protons as Reporters in Non-Deuterated Proteins by...
Phys. Chem. Chem. Phys., 2015, Accepted ManuscriptDOI: 10.1039/C5CP06601H, PaperSuresh Kumar Vasa, Petra Rovo, Karin Giller, Stefan Becker, Rasmus LinserInteractions within proteins, with their...
View ArticleFacile synthesis of highly conductive sulfur-doped reduced graphene oxide sheets
Phys. Chem. Chem. Phys., 2015, Accepted ManuscriptDOI: 10.1039/C5CP05475C, Paperzhengshan tian, Jitao Li, Gangyi Zhu, Junfeng Lu, Yueyue Wang, Zenliang Shi, Chunxiang XuA facile hydrothermal strategy...
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High thermoelectric performance from optimization of hole-doped CuInTe2
Phys. Chem. Chem. Phys., 2015, Advance ArticleDOI: 10.1039/C5CP05129K, PaperGang Zhou, Dong Wangp-Type CuInTe2 is predicted to be a promising thermoelectric material at medium temperatures by...
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Revealing photofragmentation dynamics through interactions between Rydberg...
Phys. Chem. Chem. Phys., 2015, Advance ArticleDOI: 10.1039/C5CP06185G, PaperHelgi Rafn Hro[small eth]marsson, Agust KvaranREMPI studies of HI reveal photofragmentation dynamics through interactions...
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Zigzag-edge related ferromagnetism in MoSe2 nanoflakes
Phys. Chem. Chem. Phys., 2015, Advance ArticleDOI: 10.1039/C5CP05640C, PaperBaorui Xia, Daqiang Gao, Peitao Liu, Yonggang Liu, Shoupeng Shi, Kun TaoOutstanding magnetic properties are highly desired...
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Unveiling the peculiar hydrogen bonding behavior of solvated N-heterocyclic...
Phys. Chem. Chem. Phys., 2015, Advance ArticleDOI: 10.1039/C5CP05369B, PaperOldamur HolloczkiAfter fitting a molecular mechanical force field for imidazol-2-ylidenes, MD simulations revealed...
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X-ray diffraction and high-resolution TEM observations of biopolymer...
Phys. Chem. Chem. Phys., 2015, Advance ArticleDOI: 10.1039/C5CP06107E, Paper Open Access  This article is licensed under a Creative Commons Attribution 3.0 Unported Licence.Tetsu Yonezawa,...
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Reaction between HN and SN: a possible channel for the interstellar formation...
Phys. Chem. Chem. Phys., 2015, Advance ArticleDOI: 10.1039/C5CP05190H, PaperPriya Bhasi, Zanele P. Nhlabatsi, Sanyasi SithaA computational study of the reaction between HN and NS shows the formation of...
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