Claudia Draxl

ResearcherID ORCID

Publication Activity (10 Years)

Years Active: 2017-2024
Publications (10 Years): 20

Top Topics

Electron Transfer

Crystal Structure

Molecular Dynamics

Top Venues

The journal of physical chemistry letters

Scientific data

ACS applied materials & interfaces

This page only lists publications with an associated author ORCID identifier.

Publications

Matthew L Evans, Johan Bergsma, Andrius Merkys, Casper Welzel Andersen, Oskar B Andersson, Daniel Beltrán, Evgeny Blokhin, Tara M Boland, Rubén Castañeda Balderas, Kamal Choudhary, Alberto Díaz Díaz, Rodrigo Domínguez García, Hagen Eckert, Kristjan Eimre, María Elena Fuentes Montero, Adam M Krajewski, Jens Jørgen Mortensen, José Manuel Nápoles Duarte, Jacob Pietryga, Ji Qi, Felipe de Jesús Trejo Carrillo, Antanas Vaitkus, Jusong Yu, Adam Zettel, Pedro Baptista de Castro, Johan Carlsson, Tiago F T Cerqueira, Simon Divilov, Hamidreza Hajiyani, Felix Hanke, Kevin Jose, Corey Oses, Janosh Riebesell, Jonathan Schmidt, Donald Winston, Christen Xie, Xiaoyu Yang, Sara Bonella, Silvana Botti, Stefano Curtarolo, Claudia Draxl, Luis Edmundo Fuentes Cobas, Adam Hospital, Zi-Kui Liu, Miguel A L Marques, Nicola Marzari, Andrew J Morris, Shyue Ping Ong, Modesto Orozco, Kristin Aslaug Persson, Kristian Sommer Thygesen, Christopher M Wolverton, Markus Scheidgen, Cormac Toher, Gareth J Conduit, Giovanni Pizzi, Saulius Gražulis, Gian Marco Rignanese, Rickard Armiento
Developments and applications of the OPTIMADE API for materials discovery, design, and data exchange. Digital discovery 3 (8) (2024)
Matthew L Evans, Johan Bergsma, Andrius Merkys, Casper Welzel Andersen, Oskar B Andersson, Daniel Beltrán, Evgeny Blokhin, Tara M Boland, Rubén Castañeda Balderas, Kamal Choudhary, Alberto Díaz Díaz, Rodrigo Domínguez García, Hagen Eckert, Kristjan Eimre, María Elena Fuentes Montero, Adam M Krajewski, Jens Jørgen Mortensen, José Manuel Nápoles Duarte, Jacob Pietryga, Ji Qi, Felipe de Jesús Trejo Carrillo, Antanas Vaitkus, Jusong Yu, Adam Zettel, Pedro Baptista de Castro, Johan Carlsson, Tiago F T Cerqueira, Simon Divilov, Hamidreza Hajiyani, Felix Hanke, Kevin Jose, Corey Oses, Janosh Riebesell, Jonathan Schmidt, Donald Winston, Christen Xie, Xiaoyu Yang, Sara Bonella, Silvana Botti, Stefano Curtarolo, Claudia Draxl, Luis Edmundo Fuentes Cobas, Adam Hospital, Zi-Kui Liu, Miguel A L Marques, Nicola Marzari, Andrew J Morris, Shyue Ping Ong, Modesto Orozco, Kristin Aslaug Persson, Kristian Sommer Thygesen, Christopher M Wolverton, Markus Scheidgen, Cormac Toher, Gareth J Conduit, Giovanni Pizzi, Saulius Gražulis, Gian Marco Rignanese, Rickard Armiento
Developments and applications of the OPTIMADE API for materials discovery, design, and data exchange. Digital discovery 3 (8) (2024)
Le Fang, Wahib Aggoune, Wei Ren, Claudia Draxl
How a Ferroelectric Layer Can Tune a Two-Dimensional Electron Gas at the Interface of LaInO 3 and BaSnO 3 : A First-Principles Study. ACS applied materials & interfaces (2023)
Luca M Ghiringhelli, Carsten Baldauf, Tristan Bereau, Sandor Brockhauser, Christian Carbogno, Javad Chamanara, Stefano Cozzini, Stefano Curtarolo, Claudia Draxl, Shyam S Dwaraknath, Ádám Fekete, James Kermode, Christoph T Koch, Markus Kühbach, Alvin Noe Ladines, Patrick Lambrix, Maja-Olivia Himmer, Sergey V Levchenko, Micael Oliveira, Adam Michalchuk, Ronald E Miller, Berk Onat, Pasquale Pavone, Giovanni Pizzi, Benjamin Regler, Gian Marco Rignanese, Jörg J Schaarschmidt, Markus Scheidgen, Astrid Schneidewind, Tatyana Sheveleva, Chuanxun Su, Denis Usvyat, Omar Valsson, Christof Wöll, Matthias Scheffler
Shared metadata for data-centric materials science. Scientific data 10 (1) (2023)
Lara Kabalan, Igor Kowalec, Santiago Rigamonti, Maria Troppenz, Claudia Draxl, Richard Catlow, Andrew James Logsdail
Investigation of the Pd (1- x ) Zn x alloy phase diagram using ab initio modelling approaches. Journal of physics. Condensed matter : an Institute of Physics journal (2023)
Le Fang, Wahib Aggoune, Wei Ren, Claudia Draxl
How a Ferroelectric Layer Can Tune a Two-Dimensional Electron Gas at the Interface of LaInO 3 and BaSnO 3 : A First-Principles Study. ACS applied materials & interfaces 15 (8) (2023)
Fabio Caruso, Maximilian Schebek, Yiming Pan, Cecilia Vona, Claudia Draxl
Chirality of Valley Excitons in Monolayer Transition-Metal Dichalcogenides. The journal of physical chemistry letters 13 (25) (2022)
Andrew M Wibowo-Teale, Trygve Helgaker, Andreas Savin, Carlo Adamo, Bálint Aradi, Alexei V Arbuznikov, Paul W Ayers, Evert Jan Baerends, Vincenzo Barone, Patrizia Calaminici, Eric Cancès, Emily A Carter, Pratim Kumar Chattaraj, Henry Chermette, Ilaria Ciofini, T Daniel Crawford, Frank de Proft, John F Dobson, Claudia Draxl, Thomas Frauenheim, Emmanuel Fromager, Patricio Fuentealba, Soumen Ghosh, Giulia Galli, Jiali Gao, Paul Geerlings, Nikitas I Gidopoulos, Peter M W Gill, Paola Gori-Giorgi, Andreas Görling, Timothy Gould, Stefan Grimme, Oleg V Gritsenko, Hans Jørgen Aagaard Jensen, Erin R Johnson, Robert O Jones, Martin Kaupp, Andreas M Köster, Leeor Kronik, Anna I Krylov, Simen Kvaal, Andre Laestadius, Mel Levy, Mathieu Lewin, Shubin Liu, Pierre-François Loos, Neepa T Maitra, Frank Neese, John P Perdew, Katarzyna Pernal, Pascal Pernot, Piotr Piecuch, Elisa Rebolini, Lucia Reining, Pina Romaniello, Adrienn Ruzsinszky, Dennis R Salahub, Matthias Scheffler, Peter Schwerdtfeger, Viktor N Staroverov, Jianwei Sun, Erik I Tellgren, David J Tozer, Samuel B Trickey, Carsten A Ullrich, Alberto Vela, Giovanni Vignale, Tomasz Adam Wesołowski, Xin Xu, Weitao Yang
DFT exchange: sharing perspectives on the workhorse of quantum chemistry and materials science. Physical chemistry chemical physics : PCCP 24 (47) (2022)
Matthias Scheffler, Martin Aeschlimann, Martin Albrecht, Tristan Bereau, Hans-Joachim Bungartz, Claudia Felser, Mark T Greiner, Axel Groß, Christoph T Koch, Kurt Kremer, Wolfgang E Nagel, Markus Scheidgen, Christof Wöll, Claudia Draxl
FAIR data enabling new horizons for materials research. Nature 604 (7907) (2022)
Martin Kuban, Santiago Rigamonti, Markus Scheidgen, Claudia Draxl
Density-of-states similarity descriptor for unsupervised learning from materials data. Scientific data 9 (1) (2022)
Casper W Andersen, Rickard Armiento, Evgeny Blokhin, Gareth J Conduit, Shyam S Dwaraknath, Matthew L Evans, Ádám Fekete, Abhijith Gopakumar, Saulius Gražulis, Andrius Merkys, Fawzi Mohamed, Corey Oses, Giovanni Pizzi, Gian Marco Rignanese, Markus Scheidgen, Leopold Talirz, Cormac Toher, Donald Winston, Rossella Aversa, Kamal Choudhary, Pauline Colinet, Stefano Curtarolo, Davide Di Stefano, Claudia Draxl, Süleyman Er, Marco Esters, Marco Fornari, Matteo Giantomassi, Marco Govoni, Geoffroy Hautier, Vinay Hegde, Matthew K Horton, Patrick Huck, Georg Huhs, Jens Hummelshøj, Ankit Kariryaa, Boris Kozinsky, Snehal Kumbhar, Mohan Liu, Nicola Marzari, Andrew J Morris, Arash A Mostofi, Kristin A Persson, Guido Petretto, Thomas Purcell, Francesco Ricci, Frisco Rose, Matthias Scheffler, Daniel Speckhard, Martin Uhrin, Antanas Vaitkus, Pierre Villars, David Waroquiers, Chris Wolverton, Michael Wu, Xiaoyu Yang
OPTIMADE, an API for exchanging materials data. Scientific data 8 (1) (2021)
Hélène Seiler, Daniela Zahn, Marios Zacharias, Patrick-Nigel Hildebrandt, Thomas Vasileiadis, Yoav William Windsor, Yingpeng Qi, Christian Carbogno, Claudia Draxl, Ralph Ernstorfer, Fabio Caruso
Accessing the Anisotropic Nonthermal Phonon Populations in Black Phosphorus. Nano letters 21 (14) (2021)
Qiang Fu, Fan Wu, Bingxue Wang, Yu-Xiang Bu, Claudia Draxl
Spatial Confinement as an Effective Strategy for Improving the Catalytic Selectivity in Acetylene Hydrogenation. ACS applied materials & interfaces 12 (35) (2020)
Christian Vorwerk, Claudia Hartmann, Caterina Cocchi, Golnaz Sadoughi, Severin N Habisreutinger, Roberto Félix, Regan G Wilks, Henry James Snaith, Marcus Bär, Claudia Draxl
Exciton-Dominated Core-Level Absorption Spectra of Hybrid Organic-Inorganic Lead Halide Perovskites. The journal of physical chemistry letters 9 (8) (2018)
Ronaldo Rodrigues Pela, Andris Gulans, Claudia Draxl
The LDA-1/2 Method Applied to Atoms and Molecules. Journal of chemical theory and computation 14 (9) (2018)
Christian Vorwerk, Claudia Hartmann, Caterina Cocchi, Golnaz Sadoughi, Severin N Habisreutinger, Roberto Félix, Regan G Wilks, Henry James Snaith, Marcus Bär, Claudia Draxl
Correction to "Exciton-Dominated Core-Level Absorption Spectra of Hybrid Organic-Inorganic Lead Halide Perovskites". The journal of physical chemistry letters 9 (12) (2018)
Pierre Corfdir, Hong Li, Oliver Marquardt, Guanhui Gao, Maciej R Molas, Johannes K Zettler, David van Treeck, Timur Flissikowski, Marek Potemski, Claudia Draxl, Achim Trampert, Sergio Fernández-Garrido, Holger T Grahn, Oliver Brandt
Crystal-Phase Quantum Wires: One-Dimensional Heterostructures with Atomically Flat Interfaces. Nano letters 18 (1) (2017)
Shufang Ji, Yuanjun Chen, Qiang Fu, Yifeng Chen, Juncai Dong, Wenxing Chen, Zhi Li, Yu Wang, Lin Gu, Wei He, Chen Chen, Qing Peng, Yu Huang, Xiangfeng Duan, Dingsheng S Wang, Claudia Draxl, Yadong Li
Confined Pyrolysis within Metal-Organic Frameworks To Form Uniform Ru3 Clusters for Efficient Oxidation of Alcohols. Journal of the American Chemical Society 139 (29) (2017)
Feng-Ren Fan, Hua Wu, Dmitrii Nabok, Shunbo Hu, Wei Ren, Claudia Draxl, Alessandro Stroppa
Electric-Magneto-Optical Kerr Effect in a Hybrid Organic-Inorganic Perovskite. Journal of the American Chemical Society 139 (37) (2017)
Wahib Aggoune, Caterina Cocchi, Dmitrii Nabok, Karim Rezouali, Mohamed Akli Belkhir, Claudia Draxl
Enhanced Light-Matter Interaction in Graphene/h-BN van der Waals Heterostructures. The journal of physical chemistry letters 8 (7) (2017)