Rustam Z Khaliullin

19PUBLICATIONS
42CO-AUTHORS
Biologically active moleculesComputational chemistryOrganic semiconductorsChemical and thermal processes in energy and combustionTheoretical quantum chemistry
Featured researcher

Get your video featured.

JoVEPublish with JoVE
Journal

Publications (19)

|Mar 21, 2026
Formaldehyde hydrazone as a methyl reagent for nickel-catalyzed cross-coupling methylation of aryl and heteroaryl electrophiles.

Daliah Farajat, Léa Philippe, Faraz Alaghemand

|Jan 15, 2026
The CP2K Program Package Made Simple.

Marcella Iannuzzi, Jan Wilhelm, Frederick Stein

|Sep 28, 2025
Structural Control of Band Gap and Polaron Delocalization in 2D Azatriangulene Covalent Organic Frameworks.

Chang Wan Kang, Ehsan Hamzehpoor, Pegah Ghamari

|Jul 10, 2025
Computational design of gallium imides for methane activation.

Sylvester Zhang, Ruofei Cheng, Peter H McBreen

|Apr 02, 2025
Direct Unconstrained Optimization of Excited States in Density Functional Theory.

Hanh D M Pham, Rustam Z Khaliullin

|Sep 11, 2024
Direct Unconstrained Optimization of Molecular Orbital Coefficients in Density Functional Theory.

Hanh D M Pham, Rustam Z Khaliullin

Pageof 4

Frequent Collaborators

5 joint publications

Chao-Jun Li

4 joint publications

Dmytro F Perepichka

3 joint publications

Hanh D M Pham

2 joint publications

Marcella Iannuzzi