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	1.	Equilibrium structure and Ti-catalyzed H2 desorption in NaAlH4 nanoparticles from density functional theory. [electronic resource] by Vegge, Tejs Producer: 20070126 In: Physical chemistry chemical physics : PCCP vol. 8 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	2.	Gamma-point lattice free energy estimates from O1 force calculations. [electronic resource] by Voss, Johannes Vegge, Tejs Producer: 20080730 In: The Journal of chemical physics vol. 128 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	3.	Structural stability of complex hydrides: LiBH4 revisited. [electronic resource] by Łodziana, Zbigniew Vegge, Tejs Producer: 20041202 In: Physical review letters vol. 93 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	4.	The role of oxygen and water on molybdenum nanoclusters for electro catalytic ammonia production. [electronic resource] by Howalt, Jakob G Vegge, Tejs Producer: 20140307 In: Beilstein journal of nanotechnology vol. 5 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	5.	Compensation effect in the hydrogenation/dehydrogenation kinetics of metal hydrides. [electronic resource] by Andreasen, Anders Vegge, Tejs Pedersen, Allan S Producer: 20070627 In: The journal of physical chemistry. B vol. 109 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	6.	Descriptors and Thermodynamic Limitations of Electrocatalytic Carbon Dioxide Reduction on Rutile Oxide Surfaces. [electronic resource] by Bhowmik, Arghya Vegge, Tejs Hansen, Heine A Producer: 20170621 In: ChemSusChem vol. 9 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	7.	A method for finding the ridge between saddle points applied to rare event rate estimates. [electronic resource] by Maronsson, Jón Bergmann Jónsson, Hannes Vegge, Tejs Producer: 20120514 In: Physical chemistry chemical physics : PCCP vol. 14 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	8.	Computational Screening of Doped α-MnO [electronic resource] by Tripkovic, Vladimir Hansen, Heine Anton Vegge, Tejs Producer: 20190124 In: ChemSusChem vol. 11 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	9.	A density functional theory study of the carbon-coating effects on lithium iron borate battery electrodes. [electronic resource] by Loftager, Simon García-Lastra, Juan María Vegge, Tejs Producer: 20180131 In: Physical chemistry chemical physics : PCCP vol. 19 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	10.	Thermodynamic and kinetic properties of hydrogen defect pairs in SrTiO3 from density functional theory. [electronic resource] by Bork, Nicolai Bonanos, Nikolaos Rossmeisl, Jan Vegge, Tejs Producer: 20111202 In: Physical chemistry chemical physics : PCCP vol. 13 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	11.	OH formation and H [electronic resource] by Kristoffersen, Henrik H Vegge, Tejs Hansen, Heine Anton Publication details: Chemical science Sep 2018 In: Chemical science vol. 9 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	12.	First principles investigation of the activity of thin film Pt, Pd and Au surface alloys for oxygen reduction. [electronic resource] by Tripkovic, Vladimir Hansen, Heine Anton Rossmeisl, Jan Vegge, Tejs Producer: 20150617 In: Physical chemistry chemical physics : PCCP vol. 17 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	13.	Decoupling strain and ligand effects in ternary nanoparticles for improved ORR electrocatalysis. [electronic resource] by Jennings, Paul C Lysgaard, Steen Hansen, Heine A Vegge, Tejs Producer: 20180129 In: Physical chemistry chemical physics : PCCP vol. 18 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	14.	Improving the Activity of M-N [electronic resource] by Svane, Katrine L Reda, Mateusz Vegge, Tejs Hansen, Heine A Producer: 20191209 In: ChemSusChem vol. 12 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	15.	Designing mixed metal halide ammines for ammonia storage using density functional theory and genetic algorithms. [electronic resource] by Jensen, Peter Bjerre Lysgaard, Steen Quaade, Ulrich J Vegge, Tejs Producer: 20150518 In: Physical chemistry chemical physics : PCCP vol. 16 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	16.	Energy-entropy competition in cation-hydroxyl interactions at the liquid water-Pt(111) interface. [electronic resource] by Kristoffersen, Henrik H Chan, Karen Vegge, Tejs Hansen, Heine Anton Producer: 20200103 In: Chemical communications (Cambridge, England) vol. 56 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	17.	R-NEB: Accelerated Nudged Elastic Band Calculations by Use of Reflection Symmetry. [electronic resource] by Mathiesen, Nicolai Rask Jónsson, Hannes Vegge, Tejs García Lastra, Juan Maria Publication details: Journal of chemical theory and computation May 2019 In: Journal of chemical theory and computation vol. 15 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	18.	Thermodynamic and Kinetic Limitations for Peroxide and Superoxide Formation in Na-O [electronic resource] by Mekonnen, Yedilfana S Christensen, Rune Garcia-Lastra, Juan M Vegge, Tejs Producer: 20180802 In: The journal of physical chemistry letters vol. 9 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	19.	Combinatorial selection of a two-dimensional 3d-TM-tetracyanoquinodimethane (TM-TCNQ) monolayer as a high-activity nanocatalyst for CO oxidation. [electronic resource] by Deng, Qingming Wu, Tiantian Chen, Guibin Hansen, Heine Anton Vegge, Tejs Producer: 20180214 In: Physical chemistry chemical physics : PCCP vol. 20 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)
	20.	A DFT-based genetic algorithm search for AuCu nanoalloy electrocatalysts for CO₂ reduction. [electronic resource] by Lysgaard, Steen Mýrdal, Jón S G Hansen, Heine A Vegge, Tejs Producer: 20160120 In: Physical chemistry chemical physics : PCCP vol. 17 Online resources: Available from publisher's website Availability: No items available. Save to lists Add to cart (remove)

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Your search returned 39 results.