Wannier functions approach to van der Waals interactions in ABINIT. - Camilo Espejo; Tonatiuh Rangel; Yann Pouillon; Aldo H. Romero; Xavier Gonze (Comput. Phys. Commun., 2012)

Recent developments in the ABINIT software package. - Xavier Gonze; François Jollet; Flavio Abreu Araujo; Donat Adams; Bernard Amadon; Thomas Applencourt; Christophe Audouze; Jean-Michel Beuken; Jordan Bieder; A. Bokhanchuk; Eric Bousquet; Fabien Bruneval; et al. (Comput. Phys. Commun., 2016)

PyProcar: A Python library for electronic structure pre/post-processing. - Uthpala Herath; Pedram Tavadze; Xu He; Eric Bousquet; Sobhit Singh; Francisco Muñoz; Aldo H. Romero (Comput. Phys. Commun., 2020)

DMFTwDFT: An open-source code combining Dynamical Mean Field Theory with various density functional theory packages. - Vijay Singh; Uthpala Herath; Benny Wah; Xingyu Liao; Aldo H. Romero; Hyowon Park (Comput. Phys. Commun., 2021)

MechElastic: A Python library for analysis of mechanical and elastic properties of bulk and 2D materials. - Sobhit Singh; Logan Lang; Viviana Dovale-Farelo; Uthpala Herath; Pedram Tavadze; François-Xavier Coudert; Aldo H. Romero (Comput. Phys. Commun., 2021)

Authorship and citation cultural nature in Density Functional Theory from solid state computational packages. - Marie Dumaz; Reese Boucher; Miguel A. L. Marques; Aldo H. Romero (Scientometrics, 2021)

Topic Modeling in Density Functional Theory on Citations of Condensed Matter Electronic Structure Packages. - Marie Dumaz; Camila Romero-Bohorquez; Donald A. Adjeroh; Aldo H. Romero (CoRR, 2023)

Enhancing material property prediction with ensemble deep graph convolutional networks. - Chowdhury Mohammad Abid Rahman; Ghadendra Bhandari; Nasser M. Nasrabadi; Aldo H. Romero; Prashnna K. Gyawali (CoRR, 2024)

Expanding PyProcar for new features, maintainability, and reliability. - Logan Lang; Pedram Tavadze; Andres Tellez; Eric Bousquet; Xu He; Francisco Muñoz; Nicolas Vasquez; Uthpala Herath; Aldo H. Romero (Comput. Phys. Commun., 2024)

Supervised Pretraining for Material Property Prediction. - Chowdhury Mohammad Abid Rahman; Aldo H. Romero; Prashnna K. Gyawali (CoRR, 2025)

ParquetDB: A Lightweight Python Parquet-Based Database. - Logan Lang; Eduardo Hernández; Kamal Choudhary; Aldo H. Romero (J. Open Source Softw., 2025)

AtomBench: A Benchmark for Generative Atomic Structure Models using GPT, Diffusion, and Flow Architectures. - Charles Rhys Campbell; Aldo H. Romero; Kamal Choudhary (CoRR, 2025)