Ahmad W. Huran

Martin Luther University Halle-Wittenberg — Germany

Physics and Astronomy · Physical Sciences

7h-index688citations14works0.02yr avg
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Research Topics

Advanced Chemical Physics Studies(5), 2D Materials and Applications(4), Machine Learning in Materials Science(4), X-ray Diffraction in Crystallography(4), Graphene research and applications(3)

Publications14 total

Two-Dimensional Noble Metal Chalcogenides in the Frustrated Snub-Square Lattice
The Journal of Physical Chemistry Letters·2023· 1 citedOpen Access
Two-Dimensional Noble Metal Chalcogenides in the Frustrated Snub-Square Lattice
arXiv (Cornell University)·2023Open Access
Two-dimensional binary metal-oxide quasicrystal approximants
2D Materials·2021· 5 citedOpen Access
Atomically Thin Pythagorean Tilings in Two Dimensions
The Journal of Physical Chemistry Letters·2021· 7 cited
Exchange-correlation functionals for band gaps of solids: benchmark, reparametrization and machine learning
npj Computational Materials·2020· 314 citedOpen Access
Novel two-dimensional silicon–carbon binaries by crystal structure prediction
Physical Chemistry Chemical Physics·2020· 13 cited
Tight‐Binding Parameterizations of Ti and Ba Oxides and Their Application for the Prediction of 2D Phases
physica status solidi (b)·2019· 3 citedOpen Access
Large-Scale Benchmark of Exchange–Correlation Functionals for the Determination of Electronic Band Gaps of Solids
Journal of Chemical Theory and Computation·2019· 283 citedOpen Access
Structural prediction of stabilized atomically thin tin layers
npj 2D Materials and Applications·2019· 17 citedOpen Access
Spherical aromaticity and electron delocalization in $${\text{C}}_8$$ C 8 and $${\text{B}}_4{\text{N}}_4$$ B 4 N 4 cubic systems
Theoretical Chemistry Accounts·2018· 4 cited
The Electronic Structure of Beryllium Chains
The Journal of Physical Chemistry A·2018· 6 cited
Efficient Automatized Density-Functional Tight-Binding Parametrizations: Application to Group IV Elements
Journal of Chemical Theory and Computation·2018· 23 cited
A Quantum Mechanical Study of the <i><b>k</b></i>–<b><i>j</i></b> and <b><i>k</i></b>′–<b><i>j</i></b>′ Vector Correlations for the H + LiH → Li + H<sub>2</sub> Reaction
The Journal of Physical Chemistry A·2017· 9 cited
Computing the position-spread tensor in the CAS-SCF formalism II: Spin partition
Chemical Physics Letters·2016· 3 cited

Frequent Co-authors

Miguel A. L. Marques(10), Pedro Borlido(4), Silvana Botti(4), Hai‐Chen Wang(4), Stefano Evangelisti(3), Thierry Leininger(3), Fabien Tran(2), Nadia Ben Amor(2), Véronique Brumas(2), Muralidhar Nalabothula(2), Ludger Wirtz(2), Zachary Romestan(2), A. Romero(2), Jonathan Schmidt(1), T. Aull(1), Conrad Steigemann(1), Thomas Frauenheim(1), Bálint Aradi(1), Lola González‐Sánchez(1), Susana Gómez‐Carrasco(1)