( en | de | ru )

 

Disambiguation of "Kühne, Thomas D."

Author of the publication

copydeleteadd this publication to your clipboard
Efficient PAW-based bond strength analysis for understanding the In/Si(111)(8 × 2) - (4 × 1) phase transition.

, , , and . J. Comput. Chem., 38 (26): 2276-2282 (2017)

Please choose a person to relate this publication to

To differ between persons with the same name, the academic degree and the title of an important publication will be displayed. You can also use the button next to the name to display some publications already assigned to the person.

Thomas Kühne

Dr. Ing. Thomas Kühne

Thomas Kühne

Thomas Kühne

Thomas Kühne

 

Other publications of authors with the same name

Computing and Compressing Electron Repulsion Integrals on FPGAs., , , , and . FCCM, page 162-173. IEEE, (2023)Assessing the accuracy of improved force-matched water models derived from Ab initio molecular dynamics simulations., , , , , , and . J. Comput. Chem., 37 (19): 1828-1838 (2016)Impact of finite-temperature and condensed-phase effects on theoretical X-ray absorption spectra of transition metal complexes., , , , , , and . J. Comput. Chem., 40 (5): 712-716 (2019)Enabling Electronic Structure-Based Ab-Initio Molecular Dynamics Simulations with Hundreds of Millions of Atoms., , , , , , , , , and 1 other author(s). CoRR, (2021)Accurate Sampling with Noisy Forces from Approximate Computing., , , and . CoRR, (2019)Evaluating the Design Space for Offloading 3D FFT Calculations to an FPGA for High-Performance Computing., , , and . ARC, volume 12700 of Lecture Notes in Computer Science, page 285-294. Springer, (2021)Efficient Ön-the-Fly" calculation of Raman Spectra from Ab-Initio molecular dynamics: Application to hydrophobic/hydrophilic solutes in bulk water., and . J. Comput. Chem., 36 (29): 2188-2192 (2015)Nuclear quantum effects induce metallization of dense solid molecular hydrogen., , and . J. Comput. Chem., 39 (5): 262-268 (2018)Towards electronic structure-based ab-initio molecular dynamics simulations with hundreds of millions of atoms., , , , , , , , , and 1 other author(s). Parallel Comput., (2022)Accurate Sampling with Noisy Forces from Approximate Computing., , , and . Comput., 8 (2): 39 (2020)