Mani Lokamani

Helmholtz-Zentrum Dresden-Rossendorf — Germany

Earth and Planetary Sciences · Physical Sciences

6h-index134citations33works0.92yr avg
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Research Topics

High-pressure geophysics and materials(10), Machine Learning in Materials Science(7), Advanced Chemical Physics Studies(6), Spectroscopy and Quantum Chemical Studies(5), Geophysical and Geoelectrical Methods(3)

Publications33 total

HELIPORT (HELmholtz ScIentific Project WORkflow PlaTform)
RODARE·2026Open Access
Data publication: Static and dynamic simulation approach using density-functional tight-binding in molecular electronics
RODARE·2026Open Access
The CP-PAW code package for first-principles calculations from a user's perspective
ArXiv.org·2026Open Access
Data publication: Static and dynamic simulation approach using density-functional tight-binding in molecular electronics
RODARE·2026Open Access
The CP-PAW code package for first-principles calculations from a user's perspective
arXiv (Cornell University)·2026Open Access
Erratum: Influence of finite temperature exchange-correlation effects in hydrogen [Phys. Rev. B <b>101</b>, 195129 (2020)]
Physical review. B./Physical review. B·2025· 1 citedOpen Access
Probing iron in Earth’s core with molecular-spin dynamics
Proceedings of the National Academy of Sciences·2024· 4 citedOpen Access
Electrical conductivity of warm dense hydrogen from ohm’s law and time-dependent density functional theory
Electronic Structure·2024· 3 citedOpen Access
Electrical Conductivity of Warm Dense Hydrogen from Ohm's Law and Time-Dependent Density Functional Theory
arXiv (Cornell University)·2024Open Access
Machine learning-driven structure prediction for iron hydrides
Physical Review Materials·2024· 1 cited
<i>Ab initio</i> insights on the ultrafast strong-field dynamics of anatase <mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML"><mml:msub><mml:mi mathvariant="normal">TiO</mml:mi><mml:mn>2</mml:mn></mml:msub></mml:math>
Physical review. B./Physical review. B·2023· 1 cited
Probing Iron in Earth's Core With Molecular-Spin Dynamics
arXiv (Cornell University)·2023· 1 citedOpen Access
Machine Learning-Driven Structure Prediction for Iron Hydrides
arXiv (Cornell University)·2023Open Access
Impact of electronic correlations on high-pressure iron: insights from time-dependent density functional theory
Electronic Structure·2023· 5 citedOpen Access
Overarching Data Management Ecosystem at HZDR
Proceedings of the Conference on Research Data Infrastructure·2023Open Access
Transferable interatomic potential for aluminum from ambient conditions to warm dense matter
Physical Review Research·2023· 10 citedOpen Access
Averaging over atom snapshots in linear-response TDDFT of disordered systems: A case study of warm dense hydrogen
The Journal of Chemical Physics·2023· 15 citedOpen Access
Stretch Evolution of Electronic Coupling of the Thiophenyl Anchoring Group with Gold in Mechanically Controllable Break Junctions
The Journal of Physical Chemistry Letters·2023· 2 citedOpen Access
Transferable Interatomic Potentials for Aluminum from Ambient Conditions to Warm Dense Matter
arXiv (Cornell University)·2023Open Access
Electrical conductivity of iron in Earth's core from microscopic Ohm's law
Physical review. B./Physical review. B·2023Open Access
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Frequent Co-authors

Attila Cangi(20), Kushal Ramakrishna(18), Jan Vorberger(11), Julien Tranchida(7), Mitchell Wood(7), Tobias Dornheim(6), Jeffrey Kelling(6), Zhandos A. Moldabekov(5), Svetoslav Nikolov(5), Hossein Tahmasbi(4), Andrew Baczewski(4), Oliver Knodel(4), Martin Voigt(4), David Pape(4), S. Müller(4), Guido Juckeland(3), Kurt V. Gothelf(3), Robert Ufer(3), Svetoslav Nikolov(2), Sandeep Kumar(2)