STSM – Short Term Scientific Missions
8th Call for STSM (Short Term Scientific Missions)
For missions occurring between November 1st 2023 and April 1st 2024
STSM Grantees Grant Period 1 (2020)
Francesca Fasulo
University of Naples
Federico II Polytechnic and Basic Sciences School
Italy
francesca.fasulo@unina.it
Host
Not for publication
Topic
H2O adsorption/desorption on stoichiometric and defective TiO2 surfaces: from one to more H2O layer
STSM Grantees Grant Period 2 (2021)
Jon Eunan Quinlivan Domínguez
Universitat de Barcelona
Spain
jon.quinlivan@ub.edu
Host
Dr. Johannes Margraf
Fritz-Haber-Institut Max-Planck-Gesellschaft, Berlin
Current affiliation : University of Bayreuth
johannes.margraf@uni-bayreuth.de
Topic
Training in the development of atomistic Machine-learning potentials
Dr. Veerpandian Ponnuchamy
InnoRenew CoE , Izola
Slovenia
v.ponnuchamy@tue.nl
Host
Dr. Silvia Nedea
Current affiliation : Eindhoven University of Technology, THE Netherands
Netherlands
s.v.nedea@tue.nl
Topic
Biomass reforming into hydrogen production with ZrO2 using ReaxFF
Prof Nicolae Goga
Politehnica Bucharest
Romania
n.goga@rug.nl
Host
Dr. Silvia Nedea
Technical University of Eindhoven, the Netherlands,
Netherlands
s.v.nedea@tue.nl
Topic
Molecular Dynamics STM
Sean Dvir
Technion-Israel Institute of Technology, Haifa
Israel
sean.dvir@campus.technion.ac.il
Host
Prof. Florian Libisch
TU Wien
Austria
fortran.flo@gmail.com
Topic
Learn and implement a Krylov-based scheme for charge transport across catalyst materials
Dr. Veera Krasnenko
Institute of Physics, Tartu
Estonia
Veera.Krasnenko@ut.ee
Host
Prof. Eugene Kotomin
Institute of Solid State Physics, University of Latvia
Latvia
e.kotomin@fkf.mpg.de
Topic
Water splitting on multi-facet STO nanostructure: calculation of Raman spectrum
Flavio Siro Brigiano
VUB (Vrije Universiteit Brussel)
(Current affiliation : Laboratoire de Chimie Théorique, Sorbonne Université, Paris, France)
Belgium
flavio.siro_brigiano@sorbonne-universite.fr
Host
Prof. Frances Illas Riera
Institute of Theoretical and Computational Chemistry at the Universitat de Barcelona (IQTCUB)
Spain
francesc.illas@ub.edu
Topic
XPS on water splitting
Dr. Silvia Nedea
Technische Universiteit Eindhoven
Netherlands
s.v.nedea@tue.nl
Host
Prof. Nicolae Goga
Politehnica Bucharest
Romania
n.goga@rug.nl
Topic
Machine learning methods for heat and flow properties: hydrogen-surface interactions
STSM Grantees Grant Period 3 (2022)
Eitan Yohanan
Technion-Israel Institute of Technology, Haifa
Israel
eitan.yohanan@bruker.com
Host
Dr. Jose Gomes
University of Aveiro, PT
Portugal
jrgomes@ua.pt
Topic
The effect of interlayer stacking arrangements in NiOOH nano particles on Water oxidation catalysis
Prof Nicolae Goga
Politehnica Bucharest
Romania
n.goga@rug.nl
Host
Dr. Silvia Nedea
Technical University of Eindhoven, the Netherlands,
Netherlands
s.v.nedea@tue.nl
Topic
Multiscaling modeling for water spliting
Dr. Silvia Nedea
Technical University of Eindhoven
Netherlands
s.v.nedea@tue.nl
Host
Prof. Nicolae Goga
Politehnica Bucharest
Romania
n.goga@rug.nl
Topic
AI Models for H2 interactions with a Ni surface
Anna Vidal López
University Autonomous of Barcelona
Spain
Anna.Vidal.Lopez@uab.cat
Host
Prof. Dr. Georg K. H. Madsen
Vienna University of Technology
Austria
georg.madsen@tuwien.ac.at
Topic
GPAW Code Training to Model Heterogeneous CatalystsTechnical University of Eindhoven
Estefanía Díaz López
Universitat Autònoma de Barcelona
Spain
estefania.diaz@uab.cat
Host
Prof. Dr. Georg K. H. Madsen
Vienna University of Technology, Austria
Austria
georg.madsen@tuwien.ac.at
Topic
Development of ML potentials applied to energy-relevant heterogeneous catalysts
Francesca Fasulo
University of Naples, Federico II Polytechnic and Basic Sciences School
Italy
francesca.fasulo@unina.it
Host
Prof. Laura Gagliardi
University of Chicago, US
USA
lgagliardi@uchicago.edu
Topic
Disentanglement of oxygen evolution pathways at IrO2 interface by DFT- embedding methods
STSM Grantees Grant Period 4 (2023)
Misha Aghamalyan
Yerevan State University (Yerevan, Armenia)
Armenia
misha.aghamalyan@ysu.am
Host
Dr. Assa Sasikala Devi
University of Oulu
Finland
Assa.SasikalaDevi@oulu.fi
Topic
Hydrogen Evolution Reaction Catalyst Design through Computational Material Discovery
Andrés Felipe Usuga
University Autonomous of Barcelona
Spain
andresfelipe.usuga@uab.cat
Host
Dr. Johannes Margraf
Fritz-Haber-Institut Max-Planck-Gesellschaft, Berlin
Current affiliation : University of Bayreuth
Germany
johannes.margraf@uni-bayreuth.de
Topic
Machine-Learning Driven Global Optimization of Intermediates in the CO2 Hydrogenation to Ethanol
Miquel Alles Coll
Universitat de Barcelona
Spain
miquelalles8@gmail.com
Host
Dr. Michael Nolan
Tyndall National Institute at University College Cork
Ireland
michael.nolan@tyndall.ie
Topic
Investigation of the water splitting reaction on ZnO surfaces in the excited states
Said Hamad Gomez
Universidad Pablo de Olavide de Sevilla
Spain
said@upo.es
Host
Dr. Ricardo Grau-Crespo
University of Reading
GB
r.grau-crespo@reading.ac.uk
Topic
Fine-tuning water-splitting photocatalysts based on zeolitic imidazolate frameworks via metal mixing
Charlotte Hall
University of Reading
UK
charlotte.hall@pgr.reading.ac.uk
Host
Not for publication
Topic
Computational and experimental study of spinel oxide photocatalysts for water splitting
Neeraj Mishra
Ben-Gurion University of the Negev,Beersheva
Israel
neeraj@post.bgu.ac.il
Host
Prof. Debesh R. Roy
Sardar Vallabhbhai National Institute of Technology, Surat-395007, Gujarat
India
drr@phy.svnit.ac.in
Topic
Investigation of energy harvesting properties in cubic tin monochalcogenides: Thermoelectric and optical properties
Lakhanlal Lakhanlal
Technion-Israel Institute of Technology, Haifa
Israel
lakhanlall@campus.technion.ac.il
Host
Not for publication
Topic
Iron-based Metal Organic Framework for Nitrogen Reduction and water splitiing
Sergejs Piskunovs
Institute of Solid State Physics of University of Latvia
Latvia
piskunov@lu.lv
Host
Prof. Dr. Wei Cao
University of Oulu
Finland
Wei.Cao@oulu.fi
Topic
Computer modelling and experimental crosscheck of transition metal doped Co(OH)2 composite for water splitting applications
Márton Szendrő
Institute of Technical Physics and Materials Science, Budapest
Hungary
szendro.marton@ek-cer.hu
Host
Prof. Florian Libisch
Vienna University of Technology (TU Wien)
Austria
fortran.flo@gmail.com
Topic
Investigation of large-wavelength moiré-heterostructures by tight-binding methods
Veton Haziri
University for Business and Technology – UBT, Prishtine
Kosovo
veton.haziri@ubt-uni.net
Host
Prof. Klemen Bohinc
University of Ljubljana
Slovania
klemen.bohinc@zf.uni-lj.si
Topic
The impact of water splitting on hematite charge properties
Jourdain de Thieulloy Laure
DTU ENERGY (Kgs. Lyngby)
Denmark
lajour@dtu.dk
Host
Prof. Leticia González
University of Vienna – Institute of Theoretical Chemistry
Austria
leticia.gonzalez@univie.ac.at
Topic
Nonadiabatic dynamics simulations for the investigation of efficient water splitting reaction
Dr. Giovanni Talarico
Università degli Studi di Napoli Federico II (Naples, Italy)
Italy
talarico@unina.it
Host
Prof. Luigi Cavallo
King Abdullah University of Science and Technology
Saudi Arabia
luigi.cavallo@kaust.edu.sa
Topic
Computational descriptors for water splitting reactions