Microstructure degradation of Ni/CGO anodes for solid oxide fuel cells after long operation time using 3D reconstructions by FIB tomography

JOURNAL ARTICLE published 2017 in Physical Chemistry Chemical Physics

Research funded by Bundesministerium für Bildung und Forschung (03SF0494E)

Authors: Atef Zekri | Martin Knipper | Jürgen Parisi | Thorsten Plaggenborg

Phase transformations, anisotropic pyroelectric energy harvesting and electrocaloric properties of (Pb,La)(Zr,Sn,Ti)O₃ single crystals

JOURNAL ARTICLE published 2017 in Physical Chemistry Chemical Physics

Research funded by National Natural Science Foundation of China (50972071,51172118)

Authors: Fangping Zhuo | Qiang Li | Jinghan Gao | Qingfeng Yan | Yiling Zhang | Xiaoqing Xi | Xiangcheng Chu

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JOURNAL ARTICLE published 2017 in Phys. Chem. Chem. Phys.

Attosecond charge migration following oxygen K-shell ionization in DNA bases and base pairs

JOURNAL ARTICLE published 2021 in Physical Chemistry Chemical Physics

Authors: Fatemeh Khalili | Mohsen Vafaee | Babak Shokri

Hybrid density functional theoretical study of NASICON-type Na_xTi₂(PO₄)₃ (x = 1–4)

JOURNAL ARTICLE published 2020 in Physical Chemistry Chemical Physics

Research funded by European Regional Development Fund (01.2.2-LMT-K-718-02-0005)

Authors: Denis Gryaznov | Shannon K. Stauffer | Eugene A. Kotomin | Linas Vilčiauskas

Effect of cooling on droplet size in supersaturation-induced emulsions

JOURNAL ARTICLE published 2017 in Physical Chemistry Chemical Physics

Research funded by National Science Foundation (1510826)

Authors: Shirui Luo | Jarrod Schiffbauer | Tengfei Luo

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JOURNAL ARTICLE published 2017 in Physical Chemistry Chemical Physics

Isomerization of methoxy radical in the troposphere: competition between acidic, neutral and basic catalysts

JOURNAL ARTICLE published 2017 in Physical Chemistry Chemical Physics

Research funded by Science and Engineering Research Board (ECR/2016/000279,ECR/2016/000280)

Authors: Saptarshi Sarkar | Subhasish Mallick | Deepak Deepak | Pradeep Kumar | Biman Bandyopadhyay

Hydrogen bonds, and σ-hole and π-hole bonds – mechanisms protecting doublet and octet electron structures

JOURNAL ARTICLE published 2017 in Physical Chemistry Chemical Physics

Research funded by Eusko Jaurlaritza (GIC IT-588-13) | Ministerio de Economía y Competitividad (CTQ2016-80955) | Federación Española de Enfermedades Raras (CTQ2016-80955)

Authors: Sławomir J. Grabowski

Influence of the nature of the anchoring group on electron injection processes at dye–titania interfaces

JOURNAL ARTICLE published 2017 in Physical Chemistry Chemical Physics

Authors: Imane Arbouch | David Cornil | Yasser Karzazi | Belkheir Hammouti | Roberto Lazzaroni | Jérôme Cornil

Site-specific time-resolved FRET reveals local variations in the unfolding mechanism in an apparently two-state protein unfolding transition

JOURNAL ARTICLE published 2018 in Physical Chemistry Chemical Physics

Authors: Sandhya Bhatia | G. Krishnamoorthy | Jayant B. Udgaonkar

Effects of sodium cationization versus protonation on the conformations and N-glycosidic bond stabilities of sodium cationized Urd and dUrd: solution conformation of [Urd+Na]⁺is preserved upon ESI

JOURNAL ARTICLE published 2017 in Physical Chemistry Chemical Physics

Research funded by Office of International Science and Engineering (OISE-0730072,OISE-1357887) | Division of Chemistry (CHE-1409420) | Division of Biological Infrastructure (DBI_0922819)

Authors: Y. Zhu | H. A. Roy | N. A. Cunningham | S. F. Strobehn | J. Gao | M. U. Munshi | G. Berden | J. Oomens | M. T. Rodgers

Isotope effects on the resonance interactions and vibrational quantum dynamics of fluoroform ^12,13CHF₃

JOURNAL ARTICLE published 2017 in Phys. Chem. Chem. Phys.

Research funded by Schweizerischer Nationalfonds zur Förderung der Wissenschaftlichen Forschung (200020_153057) | FP7 Ideas: European Research Council (290925)

Authors: Sieghard Albert | Elena Bekhtereva | Irina Bolotova | Ziqiu Chen | Csaba Fábri | Hans Hollenstein | Martin Quack | Oleg Ulenikov

Generalized structural motif model for studying the thermodynamic stability of fullerenes: from C₆₀to graphene passing through giant fullerenes

JOURNAL ARTICLE published 2017 in Physical Chemistry Chemical Physics

Research funded by European Cooperation in Science and Technology (CM1204 XLIC) | Ministerio de Economía y Competitividad (CTQ2013-43698-P,RYC-2010-07019,María de Maeztu Programme for Units of Excellence,FIS2016-77889-R,FIS2013- 42002-R,CTQ2016- 76061-P)

Authors: Yang Wang | Sergio Díaz-Tendero | Manuel Alcamí | Fernando Martín

NMR of molecular endofullerenes dissolved in a nematic liquid crystal

JOURNAL ARTICLE published 2017 in Physical Chemistry Chemical Physics

Research funded by Engineering and Physical Sciences Research Council (EP/M001962/1,EP/N002482/1)

Authors: Karel Kouřil | Christopher Wickens | Benno Meier | Shamim Alom | John Gräsvik | Richard J. Whitby | Malcolm H. Levitt

Single-layer MoS₂formation by sulfidation of molybdenum oxides in different oxidation states on Au(111)

JOURNAL ARTICLE published 2017 in Physical Chemistry Chemical Physics

Research funded by Det Frie Forskningsråd (1335-00016)

Authors: Norberto Salazar | Igor Beinik | Jeppe V. Lauritsen

Fracture mechanisms in multilayer phosphorene assemblies: from brittle to ductile

JOURNAL ARTICLE published 2017 in Physical Chemistry Chemical Physics

Authors: Ning Liu | Jiawang Hong | Xiaowei Zeng | Ramana Pidaparti | Xianqiao Wang

Potassium adsorption behavior on hcp cobalt as model systems for the Fischer–Tropsch synthesis: a density functional theory study

JOURNAL ARTICLE published 2017 in Physical Chemistry Chemical Physics

Research funded by Norges Forskningsråd (228741)

Authors: Qingjun Chen | Ingeborg-Helene Svenum | Yanying Qi | Ljubisa Gavrilovic | De Chen | Anders Holmen | Edd A. Blekkan

Investigation of surface energies in spin crossover nanomaterials: the role of surface relaxations

JOURNAL ARTICLE published 2017 in Physical Chemistry Chemical Physics

Research funded by Agence Nationale de la Recherche (ANR-13-BS07-0020-01)

Authors: Mirko Mikolasek | William Nicolazzi | Férial Terki | Gábor Molnár | Azzedine Bousseksou

Modulating the electronic structure of lanthanum manganite by ruthenium doping for enhanced photocatalytic water oxidation

JOURNAL ARTICLE published 2017 in Physical Chemistry Chemical Physics

Authors: Anindya Sundar Patra | Gaurangi Gogoi | Ranjan Kumar Sahu | Mohammad Qureshi