Daniel Tunega

According to our database, Daniel Tunega authored at least 5 papers between 2003 and 2025.

Collaborative distances:

• Dijkstra number of five.
• Erdős number of five.

2025

Theoretical Study on Adsorption of Halogenated Benzenes on Montmorillonites Modified With M(I)/M(II) Cations.

Daniel Tunega, Martin H. Gerzabek, Leonard Böhm

J. Comput. Chem., 2025

2024

Modeling adsorption reactions of ammonium perchlorate on rutile and anatase surfaces.

Jerimiah A. Zamora, Armando de Rezende, Reed Nieman, Neil Vaz, Andrew R. Demko, Michelle L. Pantoya, Daniel Tunega, Adélia J. A. Aquino

J. Comput. Chem., December, 2024

2011

Understanding of bonding and mechanical characteristics of cementitious mineral tobermorite from first principles.

Daniel Tunega, Ali Zaoui

J. Comput. Chem., 2011

2010

Thermodynamic stability of hydrogen-bonded systems in polar and nonpolar environments.

Hasan Pasalic, Adélia J. A. Aquino, Daniel Tunega, Georg Haberhauer, Martin H. Gerzabek, Herbert C. Georg, Tatiane F. Moraes, Kaline Coutinho, Sylvio Canuto, Hans Lischka

J. Comput. Chem., 2010

2003

Adsorption of organic substances on broken clay surfaces: A quantum chemical study.

Adélia J. A. Aquino, Daniel Tunega, Georg Haberhauer, Martin H. Gerzabek, Hans Lischka

J. Comput. Chem., 2003