Tim Kowalczyk
11PUBLICATIONS
55CO-AUTHORS
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Publications (11)
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|Dec 13, 2025
A Restriction-Based Configuration Interaction Approach Based on LC-DFTB: An Efficient Method for Field-Induced Charge Transfer in Molecular Systems.Ji Huang, Tim Kowalczyk, Yoshio Nishimoto
|Jun 06, 2025
Recent Developments in DFTB+, a Software Package for Efficient Atomistic Quantum Mechanical Simulations.B Hourahine, M Berdakin, J A Bich
|Feb 19, 2025
Intermolecular N-N Coupling of a Dinitrosyl Iron Complex Induced by Hydrogen Bond Donors in the Secondary Coordination Sphere.Kayla M Fugami, Gabriel S Black, Tim Kowalczyk
|May 09, 2024
Simulation of interlayer coupling for electroactive covalent organic framework design.Tanner M Leo, Megan Robbins, Alana Sullivan
|Sep 05, 2023
Sequential Deoxygenation of CO2 and NO2- via Redox-Control of a Pyridinediimine Ligand with a Hemilabile Phosphine.Hanalei R Lewine, Allison G Teigen, April M Trausch
|Apr 08, 2023
Electronic transition dipole moments from time-independent excited-state density-functional tight-binding.Megan Y Deshaye, Alex T Wrede, Tim Kowalczyk
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Frequent Collaborators
3 joint publications
John D Gilbertson
3 joint publications
Stephan Irle
2 joint publications
B Hourahine
2 joint publications
B Aradi
2 joint publications
A M N Niklasson
2 joint publications
C Camacho
2 joint publications
T Niehaus
2 joint publications
S Ehlert
2 joint publications
T van der Heide
2 joint publications
S K Min
