André K. Kelkkanen

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All published works

Action	Title	Year	Authors
+ PDF Chat	Evaluation of a density functional with account of van der Waals forces using experimental data of H<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:msub><mml:mrow /><mml:mn>2</mml:mn></mml:msub></mml:math>physisorption on Cu(111)	2011	Kyuho Lee André K. Kelkkanen Kristian Berland Stig Andersson David C. Langreth Elsebeth Schröder Bengt I. Lundqvist Per Hyldgaard
+ PDF Chat	Ab Initio van der Waals Interactions in Simulations of Water Alter Structure from Mainly Tetrahedral to High-Density-Like	2011	Andreas Møgelhøj André K. Kelkkanen Kjartan Thor Wikfeldt Jakob Schiøtz Jens Jørgen Mortensen Lars G. M. Pettersson Bengt I. Lundqvist Karsten W. Jacobsen Anders Nilsson Jens K. Nørskov
+	Ab initio van der Waals interactions in simulations of water alter structure from mainly tetrahedral to high-density-like	2011	Andreas Møgelhøj André K. Kelkkanen Kjartan Thor Wikfeldt Jakob Schiøtz Jens Jørgen Mortensen Lars G. M. Pettersson Bengt I. Lundqvist Karsten W. Jacobsen Anders Nilsson Jens K. Nørskov
+	Ab initio van der Waals interactions in simulations of water alter structure from mainly tetrahedral to high-density-like	2011	Andreas Møgelhøj André K. Kelkkanen Kjartan Thor Wikfeldt Jakob Schiøtz Jens Jørgen Mortensen Lars G. M. Pettersson Bengt I. Lundqvist Karsten W. Jacobsen Anders Nilsson Jens K. Nørskov
+ PDF Chat	Graphene on metals: A van der Waals density functional study	2010	Marco Vanin Jens Jørgen Mortensen André K. Kelkkanen J. M. García‐Lastra Kristian S. Thygesen Karsten W. Jacobsen

Common Coauthors

Coauthor	Papers Together
Karsten W. Jacobsen	4
Bengt I. Lundqvist	4
Jens Jørgen Mortensen	4
Jakob Schiøtz	3
Kjartan Thor Wikfeldt	3
Anders Nilsson	3
Andreas Møgelhøj	3
Jens K. Nørskov	3
Lars G. M. Pettersson	3
Stig Andersson	1
Kristian Berland	1
David C. Langreth	1
Kristian S. Thygesen	1
Elsebeth Schröder	1
Per Hyldgaard	1
Marco Vanin	1
Kyuho Lee	1
J. M. Garcı́a-Lastra	1

Commonly Cited References

Action	Title	Year	Authors	# of times referenced
+ PDF Chat	Efficient Implementation of a van der Waals Density Functional: Application to Double-Wall Carbon Nanotubes	2009	Guillermo Román‐Pérez José M. Soler	3
+ PDF Chat	Van der Waals Density Functional for General Geometries	2004	M. Dion Hanna A. Rydberg Elsebeth Schröder David C. Langreth Bengt I. Lundqvist	3
+ PDF Chat	Van der Waals density functional: Self-consistent potential and the nature of the van der Waals bond	2007	Timo Thonhauser Valentino R. Cooper Li Shen Aaron Puzder Per Hyldgaard David C. Langreth	2
+ PDF Chat	Higher-accuracy van der Waals density functional	2010	Kyuho Lee Éamonn Murray Lingzhu Kong Bengt I. Lundqvist David C. Langreth	2
+ PDF Chat	Van der Waals density functional: An appropriate exchange functional	2010	Valentino R. Cooper	2
+ PDF Chat	Real-space grid implementation of the projector augmented wave method	2005	Jens Jørgen Mortensen Lars B. Hansen Karsten W. Jacobsen	2
+ PDF Chat	Energetics and Dynamics of<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:msub><mml:mi mathvariant="bold">H</mml:mi><mml:mn>2</mml:mn></mml:msub></mml:math>Adsorbed in a Nanoporous Material at Low Temperature	2009	Lingzhu Kong Guillermo Román‐Pérez José M. Soler David C. Langreth	1
+ PDF Chat	Towards a working density-functional theory for polymers: First-principles determination of the polyethylene crystal structure	2007	Jesper Kleis Bengt I. Lundqvist David C. Langreth Elsebeth Schröder	1
+ PDF Chat	Potassium intercalation in graphite: A van der Waals density-functional study	2007	Eleni Ziambaras Jesper Kleis Elsebeth Schröder Per Hyldgaard	1
+ PDF Chat	Electric Field Effect in Atomically Thin Carbon Films	2004	Kostya S. Novoselov A. K. Geǐm С. В. Морозов Da Jiang Y. Zhang S. V. Dubonos I. V. Grigorieva А. А. Firsov	1
+ PDF Chat	X-Ray Absorption Signatures of the Molecular Environment in Water and Ice	2010	Wei Chen Xifan Wu Roberto Car	1
+ PDF Chat	Breakdown of the Stokes–Einstein relation in supercooled water	2006	Pradeep Kumar	1
+ PDF Chat	Link between the diversity, heterogeneity and kinetic properties of amorphous ice structures	2006	Michael Marek Koza Thomas C. Hansen Roland May H. Schober	1
+ PDF Chat	Tractable nonlocal correlation density functionals for flat surfaces and slabs	2000	Henrik Rydberg Bengt I. Lundqvist David C. Langreth Maxime Dion	1
+ PDF Chat	Liquid-liquid phase transitions in supercooled water studied by computer simulations of various water models	2005	Ivan Brovchenko Alfons Geiger Alla Oleinikova	1
+ PDF Chat	Doping Graphene with Metal Contacts	2008	Gianluca Giovannetti Petr A. Khomyakov Geert Brocks V. Karpan Jeroen van den Brink Paul J. Kelly	1
+ PDF Chat	Water Modeled As an Intermediate Element between Carbon and Silicon	2008	Valeria Molinero Emily B. Moore	1
+ PDF Chat	The SIESTA method for<i>ab initio</i>order-<i>N</i>materials simulation	2002	José M. Soler Emilio Artacho Julian D. Gale Alberto Garcı́a Javier Junquera Pablo Ordejón Daniel Sánchez‐Portal	1
+ PDF Chat	Vanadium pentoxide (V2O5): A van der Waals density functional study	2010	Elisa Londero Elsebeth Schröder	1
+ PDF Chat	Nature of Amorphous Polymorphism of Water	2005	Michael Marek Koza Burkhard Geil Katrin Winkel Christian Köhler Franz D. Czeschka Marco Scheuermann H. Schober Thomas C. Hansen	1
+ PDF Chat	Density, structure, and dynamics of water: The effect of van der Waals interactions	2011	Jue Wang Guillermo Román‐Pérez José M. Soler Emilio Artacho Mariví Fernández-Serra	1
+ PDF Chat	yambo: An ab initio tool for excited state calculations	2009	Andrea Marini Conor Hogan Myrta Grüning Daniele Varsano	1
+ PDF Chat	Half or full core hole in density functional theory X-ray absorption spectrum calculations of water?	2005	Matteo Cavalleri Michael Odelius Dennis Nordlund Anders Nilsson Lars G. M. Pettersson	1
+	Effect of hydrogen bond cooperativity on the behavior of water	2010	Kevin Stokely Marco G. Mazza H. Eugene Stanley Giancarlo Franzese	1
+ PDF Chat	On the accuracy of density-functional theory exchange-correlation functionals for H bonds in small water clusters. II. The water hexamer and van der Waals interactions	2008	Biswajit Santra Angelos Michaelides Martin Fuchs Alexandre Tkatchenko Claudia Filippi Matthias Scheffler	1
+ PDF Chat	Van der Waals density functional calculations of binding in molecular crystals	2010	Kristian Berland Øyvind Borck Per Hyldgaard	1
+ PDF Chat	Self-consistent order-<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mi>N</mml:mi></mml:math>density-functional calculations for very large systems	1996	Pablo Ordejón Emilio Artacho José M. Soler	1
+ PDF Chat	Structure and binding in crystals of cagelike molecules: Hexamine and platonic hydrocarbons	2010	Kristian Berland Per Hyldgaard	1