Archive for September, 2016

PCCP themed issue “Developments in Density Functional Theory”

23 Sep 2016

Click through to read the Themed Collection online Developments in Density Functional Theory, guest edited by Robert van Leeuwen, Johannes Neugebauer, Lucas Visscher and F. Matthias Bickelhaupt. Read the Editorial for an overview of the collection.


Editorial for PCCP themed issue “Developments in Density Functional Theory”
Robert van Leeuwen, Johannes Neugebauer, Lucas Visscher and F. Matthias Bickelhaupt
Phys. Chem. Chem. Phys., 2016,18, 20864-20867
DOI: 10.1039/C6CP90143C, Editorial

How molecular is the chemisorptive bond?
R. A. van Santen and I. Tranca
Phys. Chem. Chem. Phys., 2016,18, 20868-20894
DOI: 10.1039/C6CP01394E, Perspective

Time-dependent Dyson orbital theory
O. V. Gritsenko and E. J. Baerends
Phys. Chem. Chem. Phys., 2016,18, 20945-20954
DOI: 10.1039/C6CP00888G, Paper

Extension of the interacting quantum atoms (IQA) approach to B3LYP level density functional theory (DFT)
Peter Maxwell, Ángel Martín Pendás and Paul L. A. Popelier
Phys. Chem. Chem. Phys., 2016,18, 20986-21000
DOI: 10.1039/C5CP07021J, Paper

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Top 10 Reviewers for PCCP

22 Sep 2016

In celebration of Peer Review Week, with the theme of Recognition for Review – we would like to highlight the top 10 reviewers for PCCP in 2016. They have been selected by the editor for their significant contribution to the journal.

Top 10 reviewers for PCCP
Dr Jose Plata, Duke University
Dr Martijn Zwijnenburg, University College London
Professor Katsuhiko Ariga, National Institute for Materials Science
Dr Wenwei Zheng , National Institute of Diabetes and Digestive and Kidney Diseases, National Institutes of Health
Professor Martin Korth, Ulm University
Dr Antonio Cammarata, Czech Technical University in Prague
Dr Leonardo Bernasconi, STFC Rutherford Appleton Laboratory
Professor Jianing Li, University of Vermont
Professor Martin Suhm, Georg August Universitaet Goettingen
Professor Dennis Salahub, University of Calgary

We would like to say a massive thank you to these reviewers as well as the PCCP board and all of the community for their continued support of the journal, as authors, reviewers and readers.

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Introducing Associate Editor Professor Kiyotaka Asakura

19 Sep 2016

We are delighted to welcome Professor Kiyotaka Asakura as our newest Associate Editor for PCCP.

Professor Kiyotaka Asakura completed his undergraduate degree in chemistry at the University of Tokyo, Japan in 1981, and went on to complete his PhD at the same university in 1987. He subsequently moved to Germany as an Alexander von Humboldt fellow, Fritz-Haber-Instite, Berlin, then Assistant Professor, Lecturer and on to Associate Professor at the University of Tokyo, Japan. He is now Professor at the Institute for Catalysis (ICAT), Hokkaido University, Japan.

Professor Kiyotaka Asakura has expertise in X-ray spectroscopy, surface science, catalyst characterization, catalysis and microscopy and his Editorial Office can be selected on submission to PCCP.

Welcome Professor Kiyotaka Asakura.

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