Jakob Gamper

9PUBLICATIONS
14CO-AUTHORS
Metal organic frameworksStructure and dynamics of materialsNonlinear optics and spectroscopyComputational methods in fluid flow, heat and mass transfer (incl. computational fluid dynamics)Carbon capture engineering (excl. sequestration)
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Publications (9)

|Sep 12, 2025
Coupling causality and interpretable machine learning to reveal the reaction coordinate of C-N coupling with a supramolecular Cu-calix[8]arene catalyst.

R A Talmazan, J Gamper, I Castillo

|Mar 26, 2025
Comparative Study of UMCM-9 Polymorphs: Structural, Dynamic, and Hydrogen Storage Properties via Atomistic Simulations.

Josef M Gallmetzer, Jakob Gamper, Stefanie Kröll

|Jan 15, 2025
Combined Experimental and Theoretical Approach to the Electronic and Magnetic Properties of Cu-Doped LaMnO<sub>3</sub> Perovskites.

Josef M Gallmetzer, Felix R S Purtscher, Jakob Gamper

|Dec 19, 2024
Equipartitioning of Molecular Degrees of Freedom in MD Simulations of Gaseous Systems via an Advanced Thermostatization Strategy.

Jakob Gamper, Josef M Gallmetzer, Risnita Vicky Listyarini

|Apr 24, 2024
Modelling bulk and surface characteristics of cubic CeO<sub>2</sub>, Gd<sub>2</sub>O<sub>3</sub>, and gadolinium-doped ceria using a partial charge framework.

Josef M Gallmetzer, Jakob Gamper, Felix R S Purtscher

|Oct 19, 2023
Storage and Diffusion of Carbon Dioxide in the Metal Organic Framework MOF-5─A Semi-empirical Molecular Dynamics Study.

Risnita Vicky Listyarini, Jakob Gamper, Thomas S Hofer

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Frequent Collaborators

9 joint publications

Thomas S Hofer

3 joint publications

Felix R S Purtscher

3 joint publications

Josef M Gallmetzer

1 joint publications

R A Talmazan