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2018
 

Computational Screening of Light-absorbing Materials for Photoelectrochemical Water Splitting

Castelli, Ivano Eligio ; Kuhar, Korina ; Pandey, Mohnish ; Jacobsen, Karsten Wedel
part of: Advances in Photoelectrochemical Water Splitting (ISBN: 978-1-78262-925-2), pages: 62-99, 2018, Royal Society of Chemistry,

Type: Book chapter (Peer reviewed)

Status: Published     |    Year: 2018     |    DOI: http://dx.doi.org/10.1039/9781782629863-00062

2017
 

Computational High-throughput Screening for Solar Energy Materials

Castelli, Ivano Eligio ; Thygesen, Kristian Sommer ; Jacobsen, Karsten Wedel
part of: Theoretical Modeling of Organohalide Perovskites for Photovoltaic Applications (ISBN: 9781498750783), 2017, CRC Press,

Type: Book chapter

Status: Published     |    Year: 2017

2013
 

Computational design of catalysts, electrolytes and materials for energy storage

Vegge, Tejs ; Howalt, Jakob Geelmuyden ; Lysgaard, Steen ; Mýrdal, Jón Steinar Garðarsson ; Bork, N. ; Hummelshøj, Jens Strabo
part of: New and Future Developments in Catalysis: Batteries, Hydrogen Storage and Fuel Cells (ISBN: 978-0-444-53880-2), pages: 499-521, 2013, Elsevier,

Type: Book chapter (Peer reviewed)

Status: Published     |    Year: 2013     |    DOI: http://dx.doi.org/10.1016/B978-0-444-53880-2.00023-5

 

In situ powder X-ray diffraction in heterogeneous catalysis

Hansen, Jonathan ; Norby, Poul
part of: In-situ Characterization of Heterogeneous Catalysts (ISBN: 978-1-118-00016-8), pages: 121-146, 2013, John Wiley & Sons Ltd,

Type: Book chapter (Peer reviewed)

Status: Published     |    Year: 2013

2012
 

Kinetic-energy/fisher-information indicators of chemical bonds

Nalewajski, Roman F. ; de Silva, Piotr ; Mrozek, Janusz
part of: Theoretical and Computational Developments in Modern Density Functional Theory, pages: 561-588, 2012, Nova publishers,

Type: Book chapter (Peer reviewed)

Status: Published     |    Year: 2012

2008
 

Fremtidens energiforsyning

Hauch, Anne ; Hagen, Anke ; Mogensen, Mogens Bjerg ; Abrams, Billie ; Bonde, Jacob Lindner ; Vesborg, Peter Christian Kjærgaard ; Hansen, Heine Anton ; Rossmeisl, Jan
part of: Nanoteknologiske horisonter, pages: 63-79, 2008, Danmarks Tekniske Universitet (DTU), Lyngby

Type: Book chapter

Status: Published     |    Year: 2008

 

Indirect hydrogen storage in metal ammines

Vegge, Tejs ; Sørensen, Rasmus Zink ; Klerke, Asbjørn ; Hummelshøj, Jens Strabo ; Johannessen, T. ; Nørskov, Jens Kehlet ; Christensen, C.H.
part of: Solid state hydrogen storage: Materials and chemistry (ISBN: 1-84569-270-5), pages: 533-568, 2008, British Welding Research Association,

Type: Book chapter (Peer reviewed)

Status: Published     |    Year: 2008

2005
 

A QENS study of hydrogen motion in NaAlH4

Andreasen, A. ; Hjøllum, J.i. ; Vegge, Tejs ; Engberg, D. ; Niedermayer, C. ; Lefmann, Kim
part of: SINQ - experimental report (internet), 2005, Paul Scherrer Institut, Villigen

Type: Book chapter (Peer reviewed)

Status: Published     |    Year: 2005

2003
 

The effect of post-irradiation annealing on stacking fault tetrahedra in neutron-irradiated ofhc copper

Edwards, D.J. ; Singh, Bachu Narain ; Eldrup, Morten Mostgaard
part of: Fusion materials. Semiannual progress report for the period ending June 30, 2003, pages: 85-92, 2003,

Type: Book chapter

Status: Published     |    Year: 2003