Amir Hajibabaei

9PUBLICATIONS
16CO-AUTHORS
Bioinorganic chemistryContext learningChemical and thermal processes in energy and combustionStatistical mechanics in chemistryElectrical energy generation (incl. renewables, excl. photovoltaics)
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Publications (9)

|Apr 10, 2026
Nanoconfined superionic water is a molecular superionic.

Samuel W Coles, Amir Hajibabaei, Venkat Kapil

|Aug 08, 2024
Active sparse Bayesian committee machine potential for isothermal-isobaric molecular dynamics simulations.

Soohaeng Yoo Willow, Dong Geon Kim, R Sundheep

|Mar 11, 2023
Remarkably Enhanced Lattice Oxygen Participation in Perovskites to Boost Oxygen Evolution Reaction.

Aditya Narayan Singh, Amir Hajibabaei, Muhammad Hanif Diorizky

|Mar 01, 2023
Sparse Gaussian Process Regression-Based Machine Learned First-Principles Force-Fields for Saturated, Olefinic, and Aromatic Hydrocarbons.

Miran Ha, Amir Hajibabaei, Saeed Pourasad

|Jan 08, 2023
Reduced Potential Barrier of Sodium-Substituted Disordered Rocksalt Cathode for Oxygen Evolution Electrocatalysts.

Aditya Narayan Singh, Amir Hajibabaei, Miran Ha

|Jun 08, 2022
Fast atomic structure optimization with on-the-fly sparse Gaussian process potentials.

Amir Hajibabaei, Muhammad Umer, Rohit Anand

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Frequent Collaborators

6 joint publications

Kwang S Kim

2 joint publications

Chang Woo Myung

2 joint publications

Miran Ha

2 joint publications

Aditya Narayan Singh