Publications




Anisotropic optical, mechanical, and thermal properties in thickness-dependent semiconducting 2D penta-AuPS from first principles
Bohayra Mortazavi, Masoud Shahrokhikhorneh, Fazel Shojaei, Xiaoying Zhuang
Year: 2026, Results in Engineering
journal article
 
Application of irradiance–temperature gradients to reveal coordinated shifts in phenolic compounds, non-structural carbohydrates, and biomass accumulation
Jan Pleva, Daniel Vrábl, Jakub Nezval, Petr Šmilauer, Radomír Pech, Adriana Volná, Éva Olga Hideg, Nela Klusová, Vladimír Špunda
Year: 2026, Plant Stress
journal article
 
A-type helicity controls efficient nonenzymatic template copying of nucleic acids
Barbara K. Lech, Petr Jurečka, Marie Zgarbová, Rafał Szabla
Year: 2026, Chemical Communications
journal article
 
Carbon dioxide or photosynthetically active radiation? Evaluation of the significance of individual environmental factors that control leaf stomatal development
Jan Pleva, Martina Vráblová, Daniel Vrábl
Year: 2026, Annals of Botany
journal article
 
Copper-induced stress responses and phytoaccumulation capacity of three giant reed (Arundo donax L.) ecotypes
Tarek Alshaal, Éva Domokos-Szabolcsy, Gyözö Garab, Otto Zsiros, Miklós Gábor Fári, József Csajbók, Szilvia Veres, Nevien Elhawat
Year: 2026, Biomass and Bioenergy
journal article
 
DFTB Coupled with the NEGF Study of the Structural, Electronic, and Transport Properties of the Goldene 2D Material
Taoufik Sakhraoui, František Karlický
Year: 2026, The Journal of Physical Chemistry C
journal article
 
Dimensionality-driven colossal excitons in semiconducting yttrium carbide (MXene)
Jiří Kalmár, Talha KALSOOM, František Karlický
Year: 2026, Carbon Trends
journal article
 
First-principles discovery of stable, anisotropic, semiconducting Sb2X2O (X = S, Se) and Janus Sb2SSeO nanosheets for optoelectronics and photocatalysis
Masoud Shahrokhikhorneh, Bohayra Mortazavi
Year: 2026, Materials Today Energy
journal article
 
First-Principles Insights into Recently Synthesized α′–B8H4 Hydrogenated Borophene: A Stable Semiconducting Monolayer for UV Photodetection and Optoelectronic Applications
Bohayra Mortazavi, Masoud Shahrokhikhorneh, Fazel Shojaei, Xiaoying Zhuang
Year: 2026, Materials
journal article
 
First-principles investigation of novel stable, strong, and highly attractive semiconducting nanoporous C3N and CN monolayers
Bohayra Mortazavi, František Karlický, Xiaoying Zhuang, Masoud Shahrokhikhorneh
Year: 2026, Results in Chemistry
journal article
 
From Wave Function Sign Structure to Static Correlation
Matúš Dubecký
Year: 2026, Journal of Chemical Theory and Computation
journal article
 
Hetero[8]circulene-Based 2D Materials: A DFT Study of Electronic, Mechanical, and Transport Properties
Zahra Rastipour, Masoud Shahrokhikhorneh, Fazel Shojaei, Xiaoying Zhuang, Bohayra Mortazavi
Year: 2026, ACS Applied Energy Materials
journal article
 
Lipid assemblies mediating the fusion of photosystem-II enriched membranes characterized by DPH (1,6-diphenyl-1,3,5-hexatriene) fluorescence and fluorescence anisotropy lifetimes
Kinga Ilona Böde, Krisztina Sebők-Nagy, Ondřej Dlouhý, Gabor Miklos Steinbach, Aleš Benda, Gyözö Garab, Tibor Páli
Year: 2026, Journal of Photochemistry and Photobiology B: Biology
journal article
 
Machine learning-assisted first-principles study of structural, electronic, optical, thermal, and mechanical properties of novel s-triazine-based organic framework monolayers
Bohayra Mortazavi, Fazel Shojaei, Masoud Shahrokhikhorneh, Xiaoying Zhuang
Year: 2026, Carbon
journal article
 
Multifunctional Single-Atom Catalysts on N- and P-Doped Triphenylene-Graphdiyne for Water Splitting and Oxygen Reduction
Masoud Shahrokhikhorneh
Year: 2026, ACS Applied Energy Materials
journal article
 
Profiling Spatial Imagination in Exceptionally Gifted Pupils Using Mobile Eye-Tracking
Jana Slezáková, Jana Škrabánková, Stanislav Popelka
Year: 2026, Cogent Education
journal article
 
Stability of single-atom Pt-alloyed cu clusters supported on γ-Al2O3: A DFT study of size and oxidizing environment effects
Masoud Shahrokhikhorneh
Year: 2026, Computational Materials Science
journal article
 
Using Eye-Tracking Analysis on Grammar School Students to Investigate Their Spatial Imagination and Solving Tasks Related to Mathematics
Jana Slezáková, Jana Škrabánková, Stanislav Popelka, Jakub Hubáček
Year: 2026, TEM Journal - Technology, Education, Management, Informatics
journal article
 

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