The Journal of Physical Chemistry Letters
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This article is published in Journal of Physical Chemistry A.The article was published on 2009-07-16 and is currently open access. It has received 689 citations till now.read more
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Python Materials Genomics (pymatgen): A robust, open-source python library for materials analysis
Shyue Ping Ong,William D. Richards,Anubhav Jain,Geoffroy Hautier,Michael Kocher,Shreyas Cholia,Dan Gunter,Vincent Chevrier,Kristin A. Persson,Gerbrand Ceder +9 more
TL;DR: The pymatgen library as mentioned in this paper is an open-source Python library for materials analysis that provides a well-tested set of structure and thermodynamic analyses relevant to many applications, and an open platform for researchers to collaboratively develop sophisticated analyses of materials data obtained both from first principles calculations and experiments.
Journal ArticleDOI
Perspective on density functional theory
TL;DR: This perspective reviews some recent progress and ongoing challenges in density functional theory.
Journal ArticleDOI
Local strain engineering in atomically thin MoS2.
Andres Castellanos-Gomez,Rafael Roldán,Emmanuele Cappelluti,Michele Buscema,Francisco Guinea,Herre S. J. van der Zant,Gary A. Steele +6 more
TL;DR: A nonuniform tight-binding model is developed to calculate the electronic properties of MoS2 nanolayers with complex and realistic local strain geometries, finding good agreement with the experimental results.
Journal ArticleDOI
Large-scale exfoliation of inorganic layered compounds in aqueous surfactant solutions
Ronan J. Smith,Paul J. King,Mustafa Lotya,Christian Wirtz,Umar Khan,Sukanta De,Arlene O’Neill,Georg S. Duesberg,Jaime C. Grunlan,Gregory P. Moriarty,Jun Chen,Jiazhao Wang,Andrew I. Minett,Valeria Nicolosi,Jonathan N. Coleman +14 more
TL;DR: This book aims to provide a history of Tibet and its people from 1989 to 2002, a period chosen in order to explore its roots as well as specific cases up to and including the year in which descriptions of Tibetans in the region began to circulate.
Journal ArticleDOI
Graphene for energy conversion and storage in fuel cells and supercapacitors
TL;DR: In this article, the authors present an overview on electrochemical characteristics of graphene by summarizing the recent research trend on graphene for energy conversion and storage applications, such as fuel, and present an analysis of the potential of this material for next generation energy conversion devices.
References
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Journal ArticleDOI
Python Materials Genomics (pymatgen): A robust, open-source python library for materials analysis
Shyue Ping Ong,William D. Richards,Anubhav Jain,Geoffroy Hautier,Michael Kocher,Shreyas Cholia,Dan Gunter,Vincent Chevrier,Kristin A. Persson,Gerbrand Ceder +9 more
TL;DR: The pymatgen library as mentioned in this paper is an open-source Python library for materials analysis that provides a well-tested set of structure and thermodynamic analyses relevant to many applications, and an open platform for researchers to collaboratively develop sophisticated analyses of materials data obtained both from first principles calculations and experiments.
Journal ArticleDOI
Perspective on density functional theory
TL;DR: This perspective reviews some recent progress and ongoing challenges in density functional theory.
Journal ArticleDOI
Local strain engineering in atomically thin MoS2.
Andres Castellanos-Gomez,Rafael Roldán,Emmanuele Cappelluti,Michele Buscema,Francisco Guinea,Herre S. J. van der Zant,Gary A. Steele +6 more
TL;DR: A nonuniform tight-binding model is developed to calculate the electronic properties of MoS2 nanolayers with complex and realistic local strain geometries, finding good agreement with the experimental results.
Journal ArticleDOI
Large-scale exfoliation of inorganic layered compounds in aqueous surfactant solutions
Ronan J. Smith,Paul J. King,Mustafa Lotya,Christian Wirtz,Umar Khan,Sukanta De,Arlene O’Neill,Georg S. Duesberg,Jaime C. Grunlan,Gregory P. Moriarty,Jun Chen,Jiazhao Wang,Andrew I. Minett,Valeria Nicolosi,Jonathan N. Coleman +14 more
TL;DR: This book aims to provide a history of Tibet and its people from 1989 to 2002, a period chosen in order to explore its roots as well as specific cases up to and including the year in which descriptions of Tibetans in the region began to circulate.
Journal ArticleDOI
Graphene for energy conversion and storage in fuel cells and supercapacitors
TL;DR: In this article, the authors present an overview on electrochemical characteristics of graphene by summarizing the recent research trend on graphene for energy conversion and storage applications, such as fuel, and present an analysis of the potential of this material for next generation energy conversion devices.