Vibronic Coupling in the Ground State of Oligoacene Cations: The Performance of Range-Separated Hybrid Density Functionals

The Journal of Physical Chemistry C

DOI: 10.1021/jp4095326

Cai-Rong Zhang, Veaceslav Coropceanu, John S. Sears and Jean-Luc Brédas

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Dissociative Adsorption of 5-Nitro-2,4-dihydro-3H-1,2,4-triazol-3-one (NTO) on Aluminum-Terminated (0001) Surface of α-Alumina As Predicted from Plane-Wave Density Functional Theory

The Journal of Physical Chemistry C

DOI: 10.1021/jp408661h

Manoj K. Shukla and Frances Hill

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Charge Transport Limitations of Redox Mediators in Dye-Sensitized Solar Cells: Investigation Based on a Quasi-Linear Model

The Journal of Physical Chemistry C

DOI: 10.1021/jp407769s

Hui Wang, Zhe Sun, Yake Zhang, Yue Zhang, Mao Liang, Dongdong Jia and Song Xue

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Optimization of Layered Cathode Material with Full Concentration Gradient for Lithium-Ion Batteries

The Journal of Physical Chemistry C

DOI: 10.1021/jp4097887

Jin-Wook Ju, Eung-Ju Lee, Chong S. Yoon, Seung-Taek Myung and Yang-Kook Sun

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Indocyanine Green-Loaded Photoacoustic Nanodroplets: Dual Contrast Nanoconstructs for Enhanced Photoacoustic and Ultrasound Imaging

ACS Nano

DOI: 10.1021/nn403527r

Alexander Hannah, Geoffrey Luke, Katheryne Wilson, Kimberly Homan and Stanislav Emelianov

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Plasmonic Shaping in Gold Nanoparticle Three-Dimensional Assemblies

The Journal of Physical Chemistry C

DOI: 10.1021/jp406410k

Till Jägeler-Hoheisel, Julien Cordeiro, Olivier Lecarme, Aurélien Cuche, Christian Girard, Erik Dujardin, David Peyrade and Arnaud Arbouet

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Interface Chemistry Guided Long-Cycle-Life Li–S Battery

Nano Letters

DOI: 10.1021/nl4018868

Lei Wang, Dong Wang, Fengxing Zhang and Jian Jin

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Frustrated Octahedral Tilting Distortion in the Incommensurately Modulated Li3xNd2/3–xTiO3 Perovskites

Chemistry of Materials

DOI: 10.1021/cm4012052

Artem M. Abakumov, Rolf Erni, Alexander A. Tsirlin, Marta D. Rossell, Dmitry Batuk, Gwilherm Nénert and Gustaaf Van Tendeloo

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