Publications

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2019
 

Ab initio constant temperature molecular dynamics of liquid-solid interfaces

Metiu, Horia ; Kristoffersen, Henrik Høgh
in: American Chemical Society. Abstracts of Papers (at the National Meeting), vol: 256
Presented at:
256th ASC National Meeting

Type: Conference abstract in journal (Peer reviewed)

Status: Published     |    Year: 2019

 

CLEASE: Implementation of cluster expansion method in atomic simulation environment package

García Lastra, Juan Maria ; Chang, Jin ; Vegge, Tejs
in: American Chemical Society. Abstracts of Papers (at the National Meeting), vol: 257
Presented at:
257th ACS National Meeting and Exposition

Type: Conference abstract in journal (Peer reviewed)

Status: Published     |    Year: 2019

 

Contact of ZnSb thermoelectric material to metallic electrodes using S-Bond 400 solder alloy

Malik, Safdar Abbas ; Le, Thanh Hung ; Van Nong, Ngo
in: Materials Today: Proceedings, vol: 8, issue: 2, pages: 625-631
Presented at:
15th European Conference on Thermoelectrics (ECT2017)

Type: Conference article (Peer reviewed)

Status: Published     |    Year: 2019     |    DOI: https://doi.org/10.1016/j.matpr.2019.02.062

 

Correcting DFT errors through v-representable density partitioning

de Silva, Piotr ; Zhu, Tianyu ; Voorhis, Troy Van
in: American Chemical Society. Abstracts of Papers (at the National Meeting), vol: 256
Presented at:
256th ASC National Meeting

Type: Conference abstract in journal (Peer reviewed)

Status: Published     |    Year: 2019

  PDF

Cryo X-ray Absorption Spectroscopy of Copper Zinc Tin Sulfide Nanoparticles

Rein, Christian ; Ramos, Tiago ; Andreasen, Jens Wenzel
Presented at:
DanScatt Annual meeting 2019

Type: Poster

Status: Published     |    Year: 2019

  PDF

Electrospun nanofiber materials for energy and environmental applications  

Zhang, Wenjing ; Narang, Kritika ; Jasso-Salcedo, Alma ; Dou, Yibo ; Simonsen, Søren Bredmose ; Gudik-Sørensen, Mads ; Vinkel, Nadja Maria ; Akhtar, Farid ; Hedin, Niklas ; Kaiser, Andreas
in: Energy Procedia, vol: 158, pages: 6723-6724

Type: Conference abstract in journal (Peer reviewed)

Status: Published     |    Year: 2019     |    DOI: https://doi.org/10.1016/j.egypro.2019.01.016

 

Exploiting symmetry to speed up symmetric nudge elastic band calculations

García Lastra, Juan Maria ; Mathiesen, Nicolai Rask ; Vegge, Tejs
in: American Chemical Society. Abstracts of Papers (at the National Meeting), vol: 257
Presented at:
257th ACS National Meeting and Exposition

Type: Conference abstract in journal (Peer reviewed)

Status: Published     |    Year: 2019

  PDF

Grazing-incidence X-ray ptychography for in situ studies of thin sub-monolayer films of nanoparticles

Slyamov, A. M. ; Jørgensen, P. S. ; Rein, C. ; Odstrčil, M. ; Silvestre, C. M. ; Andreasen, J. W.
Presented at:
2019 International Conference on Tomography of Materials & Structures

Type: Poster

Status: Published     |    Year: 2019

  PDF

Grazing-incidence X-ray ptychography for in situ studies of thin sub-monolayer films of nanoparticles

Slyamov, A. M. ; Jørgensen, P. S. ; Rein, C. ; Odstrčil, M. ; Silvestre, C. M. ; Andreasen, J. W.
Presented at:
DanScatt Annual meeting 2019

Type: Poster

Status: Published     |    Year: 2019

 

High water flux ultrafiltration SiC membranes for water filtration applications

Leal, Candelario ; Manuel, Victor ; Agersted, Karsten ; Sudireddy, Bhaskar Reddy ; Hansen, Karsten Klemens ; Eray, Esra
part of: Abstract book of the Engineering with Membranes Conference 2019, pages: 139, 2019
Presented at:
Engineering with Membranes

Type: Conference abstract in proceedings (Peer reviewed)

Status: Published     |    Year: 2019

 

Hydrogen production without CO2: Experiments and computations

Upham, D. Chester ; Palmer, Clarke ; Zeng, Jiren ; Su, Shizhao ; Agarwal, Vishal ; Kristoffersen, Henrik Høgh ; Gordon, Michael ; McFarland, Eric ; Metiu, Horia
part of: Proceedings of the 256th ACS National Meeting and Exposition, 2019, American Chemical Society
Presented at:
256th ACS National Meeting and Exposition

Type: Conference abstract in proceedings (Peer reviewed)

Status: Published     |    Year: 2019

 

LSCF nanofiber cathodes by water-based sol-gel electrospinning for IT-SOFC applications

Costamagna, Paola ; Sala, Elena Marzia ; Zhang, Wenjing (Angela) ; Traulsen, Marie Lund ; Holtappels, Peter
part of: Proceedings of 13th European SOFC & SOE Forum 2018, 2019, European Fuel Cell Forum
Presented at:
13th European SOFC & SOE Forum 2018

Type: Conference abstract in proceedings (Peer reviewed)

Status: Published     |    Year: 2019

  PDF

Molecular Dynamics Supported In Situ X-Ray Scattering on Organic Solar Cell Layers

Gertsen, Anders S. ; Sørensen, Michael Korning ; Andreasen, Jens W.
Presented at:
CECAM Workshop: Fabrication Processes and Molecular Organization in Organic Thin-Films: Theory and Simulation Meet Experiments

Type: Poster

Status: Published     |    Year: 2019

  PDF

Molecular Dynamics Supported In Situ X-Ray Scattering on Organic Solar Cell Layers

Gertsen, Anders S. ; Sørensen, Michael Korning ; Andreasen, Jens W.
Presented at:
DanScatt Annual meeting 2019

Type: Poster

Status: Published     |    Year: 2019

  PDF

Monte Carlo Ray Tracing of Scanning Coherent Diffraction Imaging

Fevola, Giovanni ; B. Knudsen, Erik ; Ramos, Tiago ; Carbone, Dina ; Andreasen, Jens W.
Presented at:
Desy Photon Science Users' Meeting 2019

Type: Poster

Status: Published     |    Year: 2019

  PDF

Multi-scale Three-Dimensional Reconstruction of Ptychographic X-Ray Tomography Data

Slyamov, Azat M. ; Ramos, Tiago ; Andreasen, Jens W.
Presented at:
CINEMAX IV

Type: Poster

Status: Published     |    Year: 2019

  PDF

New Methodology of Studying H2S Poisoning Effects on SOFC’s Fueled by Carbon Containing Fuels like Biogas

Langnickel, H. ; Hagen, A.
in: ECS Transactions, vol: 91, issue: 1, pages: 511-521
Presented at:
16th International Symposium on Solid Oxide Fuel Cells

Type: Conference article (Peer reviewed)

Status: Published     |    Year: 2019     |    DOI: https://doi.org/10.1149/09101.0511ecst

 

Novel hybrid electricity storage system producing synthetic natural gas by integrating biomass gasification with pressurized solid oxide cells

Kofler, René ; Butera, Giacomo ; Jensen, Søren Højgaard ; Clausen, Lasse Røngaard
part of: Proceedings of ECOS 2019: 32nd International Conference on Efficiency, Cost, Optimization, Simulation and Environmental Impact of Energy Systems, 2019
Presented at:
32nd International Conference on Efficiency, Cost, Optimization, Simulation and Environmental Impact of Energy Systems (ECOS 2019)

Type: Article in proceedings (Peer reviewed)

Status: Published     |    Year: 2019

  PDF

Optimization and Durability of Reversible Solid Oxide Cells

Sun, X. ; Sudireddy, B. R. ; Tong, X. ; Chen, M. ; Brodersen, K. ; Hauch, A.
in: ECS Transactions, vol: 91, issue: 1, pages: 2631-2639
Presented at:
16th International Symposium on Solid Oxide Fuel Cells

Type: Conference article (Peer reviewed)

Status: Published     |    Year: 2019     |    DOI: https://doi.org/10.1149/09101.2631ecst

 

Phase Field Modelling of Microstructural Changes in NI/YSZ Solid Oxide Electrolysis Cell Electrodes

Trini, M. ; De Angelis, S. ; Jørgensen, P. S. ; Hauch, A. ; Chen, M. ; Hendriksen, P. V.
part of: Proceeding of the 42nd International Conference on Advanced Ceramics and Composites, pages: 165-176, 2019, American Ceramic Society

Type: Article in proceedings (Peer reviewed)

Status: Published     |    Year: 2019     |    DOI: https://doi.org/10.1002/9781119543343.ch16

 

Self-Attractive Hartree partitioning for density-based embedding

de Silva, Piotr ; Van Voorhis, Troy ; Zhu, Tianyu
in: American Chemical Society. Abstracts of Papers (at the National Meeting), vol: 257

Type: Conference abstract in journal (Peer reviewed)

Status: Published     |    Year: 2019

  PDF

Solid Oxide Development Status at DTU Energy

Hagen, A. ; Frandsen, H. L.
in: ECS Transactions, vol: 91, issue: 1, pages: 235-245
Presented at:
16th International Symposium on Solid Oxide Fuel Cells

Type: Conference article (Peer reviewed)

Status: Published     |    Year: 2019     |    DOI: https://doi.org/10.1149/09101.0235ecst

 

Static and dynamic energetic disorder in OLED materials

de Silva, Piotr ; Voorhis, Troy Van
in: American Chemical Society. Abstracts of Papers (at the National Meeting), vol: 256
Presented at:
256th ASC National Meeting

Type: Conference abstract in journal (Peer reviewed)

Status: Published     |    Year: 2019

  PDF

Status on Demonstration of Fuel Cell Based Micro-CHP Units in Europe

R. Nielsen, E. ; Prag, C. B. ; Bachmann, T. M. ; Carnicell, F. ; Boyd, E. ; Walke, I. ; Ruf, L. ; Stephens, A.
in: Fuel Cells, vol: 19, issue: 4, pages: 340-345
Presented at:
13th EUROPEAN SOFC & SOE FORUM

Type: Conference article (Peer reviewed)

Status: Published     |    Year: 2019     |    DOI: https://doi.org/10.1002/fuce.201800189

  PDF

Unwinding Entangled Degradation Mechanisms in Solid Oxide Electrolysis Cells Through Electrode Modifications and Impedance Analysis

Rao, M. ; Jensen, S. H. ; Sun, X. ; Hagen, A.
in: Fuel Cells, vol: 19, issue: 4, pages: 445-457
Presented at:
13th EUROPEAN SOFC & SOE FORUM

Type: Conference article (Peer reviewed)

Status: Published     |    Year: 2019     |    DOI: https://doi.org/10.1002/fuce.201800166