Pavel V Stishenko

7PUBLICATIONS
52CO-AUTHORS
Statistical mechanics, physical combinatorics and mathematical aspects of condensed matterData structures and algorithmsComputational chemistryFormal methods for softwareElemental semiconductors
Featured researcher

Get your video featured.

JoVEPublish with JoVE
Journal

Publications (7)

|Nov 04, 2026
EmbASI: An extensible Pythonic framework for DFT-in-DFT and WF-in-DFT embedding.

|Feb 13, 2026
Practical integration of machine learning into ab initio calculations and workflows: Accelerating the SCF cycle via density matrix predictions.

Pavel Stishenko, Chen Qian, Julia Westermayr

|Jun 06, 2025
Recent Developments in DFTB+, a Software Package for Efficient Atomistic Quantum Mechanical Simulations.

B Hourahine, M Berdakin, J A Bich

|Jul 03, 2024
Integrated workflows and interfaces for data-driven semi-empirical electronic structure calculations.

Pavel Stishenko, Adam McSloy, Berk Onat

|Jul 04, 2020
SuSMoST: Surface Science Modeling and Simulation Toolkit.

Sergey S Akimenko, Galina D Anisimova, Anastasiya I Fadeeva

|Apr 25, 2020
2-Carboxyethylgermanium Sesquioxide as A Promising Anode Material for Li-Ion Batteries.

Evgeniya A Saverina, Roman R Kapaev, Pavel V Stishenko

Pageof 2

Frequent Collaborators

3 joint publications

Andrew Logsdail

2 joint publications

Ben Hourahine

2 joint publications

Reinhard J Maurer

1 joint publications

M Berdakin