Projects per year
Search results
-
Active
Discovery of Kagome Materials for Magnetic Catalysis
Beck, P. (PhD Student), Castelli, I. E. (Main Supervisor), Hansen, H. A. (Supervisor), Vegge, T. (Supervisor) & Suntivich, J. (Supervisor)
15/10/2024 → 14/10/2027
Project: PhD
-
Electrocatalytic CO2 Reduction
Karlsson, L. (PhD Student), Bligaard, T. (Main Supervisor), Bagger, A. T. (Supervisor) & Seger, B. (Supervisor)
15/08/2024 → 14/08/2027
Project: PhD
-
Synthesis and operando investigation of atomically dispersed catalysts for electrochemical hydrogen peroxide production
Hommelgaard, M. M. (PhD Student), Hansen, H. A. (Main Supervisor), Hu, Y. (Main Supervisor) & Temperton, R. (Main Supervisor)
01/08/2024 → 31/07/2027
Project: PhD
-
Electrocatalyst Development for Polymer Electrolyte Membrane Electrolyzers Aided by In-operando Characterization
Giarola, G. (PhD Student), Hu, Y. (Main Supervisor), Chatzichristodoulou, C. (Supervisor) & Hansen, H. A. (Supervisor)
01/04/2024 → 31/03/2027
Project: PhD
-
Theory and design of anti-Hund molecules for biomedical and sustainable energy applications
Divya, D. (PhD Student), de Silva, P. (Main Supervisor) & Castelli, I. E. (Supervisor)
01/03/2024 → 28/02/2027
Project: PhD
-
PlasticCat: Computational design of a novel molecular catalyst capable of depolymerizing Nylon back into Monomers
Pan, J. (PI)
15/02/2024 → 14/02/2026
Project: Research
-
Atomic Scale Modelling of Catalystsfor Selective Electro-Oxidation
Jensen, M. D. (PhD Student), Hansen, H. A. (Main Supervisor), Kastlunger, G. (Supervisor) & Winther, K. T. (Supervisor)
01/02/2024 → 31/01/2027
Project: PhD
-
Atomic Scale Modeling of Catalysts for Electrochemical Production of Hydrogen Peroxide
Gleeson, R. (PhD Student), Hansen, H. A. (Main Supervisor) & Hu, Y. (Supervisor)
15/01/2024 → 14/01/2027
Project: PhD
-
Self-healing Materials for Photovoltaic Applications
Kortstee, L. T. J. (PhD Student), Castelli, I. E. (Main Supervisor), García Lastra, J. M. (Supervisor), Vegge, T. (Supervisor) & Bekenstein, Y. (Supervisor)
01/01/2024 → 31/12/2026
Project: PhD
-
Atomic Scale Modelling of Catalysts for the Oxygen Evolution Reaction
Nissen, M. S. (PhD Student), Hansen, H. A. (Main Supervisor) & Hu, Y. (Supervisor)
15/09/2023 → 14/09/2026
Project: PhD
-
Computational design of Stacking of oxide free-standing membranes into artificial heterostructures
Hansen, W. S. (PhD Student), García Lastra, J. M. (Main Supervisor), Bhowmik, A. (Supervisor) & Castelli, I. E. (Supervisor)
01/09/2023 → 31/08/2026
Project: PhD
-
In-silico Strategies for Battery Recycling
Jensen, M. E. (PhD Student), Castelli, I. E. (Main Supervisor), García Lastra, J. M. (Supervisor), Vegge, T. (Supervisor) & Lundström, M. (Supervisor)
15/08/2023 → 27/01/2027
Project: PhD
-
Deep generative models for inverse design of solid electrolytes
Parida, C. (PhD Student), García Lastra, J. M. (Main Supervisor), Bhowmik, A. (Supervisor) & Bernhardt, D. (Supervisor)
01/04/2023 → 31/03/2026
Project: PhD
-
Electrolyte ions for Efficient Catalysis
Sechi, R. (PhD Student), Hansen, H. A. (Main Supervisor), Bhowmik, A. (Supervisor) & Bandarenka, A. (Supervisor)
01/03/2023 → 28/02/2026
Project: PhD
-
Machine learning exchange correlation functionals for density functional theory
Hansen, T. (PhD Student), Bligaard, T. (Supervisor) & Jacobsen, K. W. (Main Supervisor)
01/02/2023 → 31/01/2026
Project: PhD
-
Theoretical modeling of single-particle catalysts
Hinrichsen, B. T. (PhD Student), Helveg, S. (Main Supervisor) & Bligaard, T. (Supervisor)
01/12/2022 → 30/11/2025
Project: PhD
-
Development of density function theory methodsfor simulations of energy materials
Dabbaghi, P. (PhD Student), de Silva, P. (Main Supervisor) & García Lastra, J. M. (Supervisor)
01/12/2022 → 30/11/2025
Project: PhD
-
Deep generative models for inverse design of sodium-ion cathode materials
Petersen, M. H. (PhD Student), García Lastra, J. M. (Main Supervisor) & Bhowmik, A. (Supervisor)
01/10/2022 → 30/09/2025
Project: PhD
-
PALSfit: Development of software for the analysis of positron lifetime spectra
Eldrup, M. M. (Project Participant), Kirkegaard, P. (Project Participant) & Olsen, J. V. (Project Participant)
01/01/2007 → …
Project: Research
-
Finished
Theoretical Catalysis and Accelerated Computational Discovery of Clean Energy Materials
Xu, M. (PhD Student), Bligaard, T. (Main Supervisor), Kastlunger, G. (Supervisor), Hellman, A. (Examiner) & Honkala, J. K. (Examiner)
01/03/2021 → 07/05/2024
Project: PhD
-
Computational Design of Electrocatalysts for the Oxygen Reduction Reaction
Sinha, S. (PhD Student), Hansen, H. A. (Main Supervisor), Vegge, T. (Supervisor), Calle-Vallejo, F. (Examiner) & Studt, F. (Examiner)
15/11/2020 → 11/03/2024
Project: PhD
-
Atomic Scale Simulations of Oxygen Reduction at the Solid-Liquid Interface
Yang, X. (PhD Student), Hansen, H. A. (Main Supervisor), Bhowmik, A. (Supervisor), Vegge, T. (Supervisor), Exner, K. S. (Examiner) & Zhang, C. (Examiner)
01/10/2020 → 11/01/2024
Project: PhD
-
Computational Studies of Hydride Catalysts for COs Reduction
Ai, C. (PhD Student), Hansen, H. A. (Main Supervisor), Vegge, T. (Supervisor), Andersen, M. (Examiner) & Hellman, A. (Examiner)
01/09/2020 → 16/11/2023
Project: PhD
-
Computational Investigations of Furfural Valorization
Liu, S. (PhD Student), Bligaard, T. (Main Supervisor), Kastlunger, G. (Supervisor), Hellman, A. (Examiner) & Holewinski, A. (Examiner)
01/09/2020 → 11/01/2024
Project: PhD
-
Computational Investigations of the Catalytic Activity of Transition Metal Nanoclusters
Tsang, S.-C. (PhD Student), Bligaard, T. (Main Supervisor), Kastlunger, G. (Supervisor), Honkala, J. K. (Examiner) & Stephens, I. E. L. (Examiner)
01/09/2020 → 11/01/2024
Project: PhD
-
Computational Design of Electrocatalysts for the Carbon dioxide Reduction Reaction
Pedersen, P. (PhD Student), Hansen, H. A. (Main Supervisor), Bligaard, T. (Supervisor), Vegge, T. (Supervisor), Lopez, N. (Examiner) & Skulason, E. (Examiner)
01/08/2020 → 16/11/2023
Project: PhD
-
Accelerating catalysis simulations using surrogate machine learning models
Vishart, A. L. (PhD Student), Jensen, J. H. (Examiner), Bligaard, T. (Main Supervisor), Chan, K. (Supervisor) & Jonsson, H. (Examiner)
01/02/2020 → 12/05/2023
Project: PhD
-
Electrochemical CO2 reduction in two-electron products
Siig, O. W. (PhD Student), Peterson, A. A. (Examiner), Rossmeisl, J. (Examiner), Bligaard, T. (Main Supervisor) & Kastlunger, G. (Supervisor)
01/12/2019 → 31/08/2023
Project: PhD
-
Computational Design of Bimetallic Nanoparticle Catalysts for Bio-Methane Steam Reforming
Han, S. (PhD Student), Reuter, K. (Examiner), Rinke, P. (Examiner), Hansen, H. A. (Main Supervisor) & Vegge, T. (Supervisor)
01/11/2019 → 27/04/2023
Project: PhD
-
Computional Studies of Carbon-based Catalysts for the Oxugen Reduction Reaction
Patniboon, T. (PhD Student), Kramm, U. (Examiner), Rossmeisl, J. (Examiner), Hansen, H. A. (Main Supervisor) & Vegge, T. (Supervisor)
15/10/2019 → 27/04/2023
Project: PhD
-
Atomic-scale modelling of magnesium batteries
Vincent, S. (PhD Student), Erhart, P. (Examiner), Scanlon, S. (Examiner), García Lastra, J. M. (Main Supervisor), Chang, J. H. (Supervisor) & Vegge, T. (Supervisor)
15/08/2019 → 16/11/2022
Project: PhD
-
High temperature fuel cells and electrolysis, from metadata to longer lifetimes
Padinjarethil, A. K. (PhD Student), Himanen, O. P. (Examiner), Menzler, N. H. (Examiner), Hagen, A. (Main Supervisor), Christensen, R. (Supervisor) & Ploner, A. (Supervisor)
01/04/2019 → 30/09/2022
Project: PhD
-
Synthesis and Characterization of Electrocatalysts for Low Temperature Fuel Cell and Water Electrolsyers
Zhou, Q. (PhD Student), Li, Q. (Main Supervisor), Cleemann, L. N. (Supervisor), Hu, Y. (Supervisor), Hansen, H. A. (Examiner), Stephens, I. (Examiner) & Ma Andersen, S. (Examiner)
01/03/2019 → 03/08/2022
Project: PhD
-
Deep Learning Enhanced Density Functional Theory (DFT) Simulation for Millions of Atoms
Bhowmik, A. (PI)
01/11/2018 → 31/08/2021
Project: Research
-
Computional design of Perovskite-based Materials for Sustainable Energy Applications
Lan, Z. (PhD Student), Giorgi, G. (Examiner), Lippert, T. (Examiner), Hansen, H. A. (Examiner), Vegge, T. (Main Supervisor) & Castelli, I. E. (Supervisor)
01/09/2018 → 08/11/2021
Project: PhD
-
Accelerating clean emergy materials discovery from second-life of data
Mikkelsen, A. E. G. (PhD Student), Ceriotti, M. (Examiner), Michaelides, A. (Examiner), Bligaard, T. (Examiner), Vegge, T. (Main Supervisor), Castelli, I. E. (Supervisor) & Schiøtz, J. (Supervisor)
01/09/2018 → 30/09/2021
Project: PhD
-
Machine Learning and AB-initio Simulations for Accelerated Materials Discovery
Bölle, F. T. (PhD Student), Hautier, G. (Examiner), Hennig, R. G. (Examiner), Hansen, H. A. (Examiner), Vegge, T. (Main Supervisor), Castelli, I. E. (Supervisor) & Thygesen, K. S. (Supervisor)
Technical University of Denmark
01/02/2018 → 12/04/2021
Project: PhD
-
Explainability of uncertainty for neural networks
Rieger, L. H. (PhD Student), Papapetrou, P. (Examiner), Samek, W. (Examiner), Madsen, K. H. (Examiner), Hansen, L. K. (Main Supervisor) & Nielsen, F. Å. (Supervisor)
Technical University of Denmark
01/09/2017 → 10/02/2021
Project: PhD
-
Computational design of electrocatalysts for CO2 reduction
Kildgaard, J. V. (PhD Student), Garcia-Lastra, J. M. (Examiner), Alonso, N. L. (Examiner), Rossmeisl, J. (Examiner), Vegge, T. (Main Supervisor) & Hansen, H. A. (Supervisor)
Eksternt finansieret virksomhed
01/09/2017 → 10/05/2021
Project: PhD
-
Density functional theory based modelling of materials for resistive switching memories
Pedersen, C. S. (PhD Student), Kioupakis, E. (Examiner), Hansen, H. A. (Examiner), García Lastra, J. M. (Main Supervisor), Chang, J. H. (Supervisor), Pryds, N. (Supervisor), Vegge, T. (Supervisor) & García-Fernández, P. (Examiner)
01/01/2017 → 09/11/2020
Project: PhD
-
Theoretical investigations of the sudden death process in metal-air batteries
Tygesen, A. S. (PhD Student), García Lastra, J. M. (Main Supervisor), Vegge, T. (Supervisor), Chang, J. H. (Supervisor), Bligaard, T. (Examiner), Siegel, D. J. (Examiner) & Doublet, M.-L. (Examiner)
Eksternt finansieret virksomhed
01/01/2017 → 09/03/2020
Project: PhD
-
Computational design of catalysts for electroreduction of nitrogen into ammonia
Pan, J. (PhD Student), Hellman, A. (Examiner), Bligaard, T. (Examiner), Honkala, J. K. (Examiner), Vegge, T. (Main Supervisor) & Hansen, H. A. (Supervisor)
Eksternt finansieret virksomhed
01/08/2016 → 30/09/2020
Project: PhD
-
TES: Thermal Energy Storage - Lab-Scale prototype
Blanchard, D. (Project Participant)
01/01/2016 → 01/01/2018
Project: Research
-
CERMAC: Cost Effective Regenerative Metal Hydride Air Cell
Blanchard, D. (Project Participant)
01/06/2013 → 01/06/2014
Project: Research
-
Udvikling og karakterisering af avancerede Li-batterier
Christiansen, A. S. (PhD Student), Jensen, S. H. (Supervisor), Norby, P. (Supervisor), Pedersen, A. S. (Examiner), Dahl, S. (Examiner), Dominko, R. (Examiner) & Holtappels, P. W. (Main Supervisor)
01/03/2011 → 02/09/2015
Project: PhD