publications

2026

1. Growth driven phase transitions in Zinc Oxide nanoparticles through machine-learning assisted simulations

   Quentin Gromoff, Magali Benoit, Jacek Goniakowski, and 2 more authors

   Nanoscale, 2026

   
2. Concerted mass transport governs anomalous diffusion in anharmonic bcc metals

   Davide G Sangiovanni, Carlos R Salazar, Ferenc Tasnádi, and 2 more authors

   2026

   
3. Bonding adaptability and transformation plasticity in Ti–Al–Si–N alloys

   Carlos R Salazar, Sheuly Ghosh, Ferenc Tasnádi, and 4 more authors

   Available at SSRN 7038127, 2026

   
4. HADB Database: From Data Generation to AI-Supported Predictions of Properties of Hard-Coating Alloy

   Ferenc Tasnádi, Jonatan Wästlund, Sheuly Ghosh, and 5 more authors

   Available at SSRN 7228547, 2026

   

2025

1. Excitation Energy Transfer between Porphyrin Dyes on a Clay Surface: A Study Employing Multifidelity Machine Learning

   Dongyu Lyu, Vivin Vinod, Matthias Holzenkamp, and 5 more authors

   Advanced Theory and Simulations, 2025

   
2. All-around local structure classification with supervised learning: The example of crystal phases and dislocations in complex oxides

   Jean Furstoss, Carlos R Salazar, Philippe Carrez, and 2 more authors

   Computer Physics Communications, 2025

   

2024

1. Competing nucleation pathways in nanocrystal formation

   Carlos R Salazar, Akshay Krishna Ammothum Kandy, Jean Furstoss, and 3 more authors

   npj Computational Materials, 2024

   

2023

1. 

   LASP2Interface

   Carlos Rafael Salazar Letona

   Jan 2023

   DOI Bib HTML

   @software{Salazar_Letona_LASP2Interface_2023,
     author = {Salazar Letona, Carlos Rafael},
     doi = {10.5281/zenodo.7592253},
     month = jan,
     title = {{LASP2Interface}},
     url = {https://lasp2interface.readthedocs.io/},
     version = {1.0.0},
     year = {2023},
   }