Paweł Tecmer

ResearcherID ORCID

Publication Activity (10 Years)

Years Active: 2019-2024
Publications (10 Years): 21

Top Topics

Electron Transfer

Systemic Sclerosis

Molecular Dynamics

Top Venues

Journal of chemical theory and computation

Physical chemistry chemical physics : PCCP

The journal of physical chemistry letters

This page only lists publications with an associated author ORCID identifier.

Publications

Rahul Chakraborty, Matheus Morato Ferreira de Moraes, Katharina Boguslawski, Artur Nowak, Julian Świerczyński, Paweł Tecmer
Toward Reliable Dipole Moments without Single Excitations: The Role of Orbital Rotations and Dynamical Correlation. Journal of chemical theory and computation 20 (11) (2024)
Matheus Morato Ferreira de Moraes, Paweł Tecmer
Towards reliable and efficient modeling of [Cu 2 O 2 ] 2+ -based compound electronic structures with the partially fixed reference space protocols. Physical chemistry chemical physics : PCCP 26 (29) (2024)
Matheus Morato Ferreira de Moraes, Paweł Tecmer
Towards reliable and efficient modeling of [Cu 2 O 2 ] 2+ -based compound electronic structures with the partially fixed reference space protocols. Physical chemistry chemical physics : PCCP (2024)
Marta Gałyńska, Matheus Morato Ferreira de Moraes, Paweł Tecmer, Katharina Boguslawski
Delving into the catalytic mechanism of molybdenum cofactors: a novel coupled cluster study. Physical chemistry chemical physics : PCCP 26 (27) (2024)
Maximilian H Kriebel, Paweł Tecmer, Marta Gałyńska, Aleksandra Leszczyk, Katharina Boguslawski
Accelerating Pythonic Coupled-Cluster Implementations: A Comparison Between CPUs and GPUs. Journal of chemical theory and computation (2024)
Maximilian H Kriebel, Paweł Tecmer, Marta Gałyńska, Aleksandra Leszczyk, Katharina Boguslawski
Accelerating Pythonic Coupled-Cluster Implementations: A Comparison Between CPUs and GPUs. Journal of chemical theory and computation 20 (3) (2024)
Rahul Chakraborty, Matheus Morato Ferreira de Moraes, Katharina Boguslawski, Artur Nowak, Julian Świerczyński, Paweł Tecmer
Toward Reliable Dipole Moments without Single Excitations: The Role of Orbital Rotations and Dynamical Correlation. Journal of chemical theory and computation 20 (11) (2024)
Maximilian H Kriebel, Paweł Tecmer, Marta Gałyńska, Aleksandra Leszczyk, Katharina Boguslawski
Accelerating Pythonic Coupled-Cluster Implementations: A Comparison Between CPUs and GPUs. Journal of chemical theory and computation 20 (3) (2024)
Rahul Chakraborty, Matheus Morato Ferreira de Moraes, Katharina Boguslawski, Artur Nowak, Julian Świerczyński, Paweł Tecmer
Toward Reliable Dipole Moments without Single Excitations: The Role of Orbital Rotations and Dynamical Correlation. Journal of chemical theory and computation (2024)
Marta Gałyńska, Matheus Morato Ferreira de Moraes, Paweł Tecmer, Katharina Boguslawski
Delving into the catalytic mechanism of molybdenum cofactors: a novel coupled cluster study. Physical chemistry chemical physics : PCCP (2024)
Maximilian H Kriebel, Paweł Tecmer, Marta Gałyńska, Aleksandra Leszczyk, Katharina Boguslawski
Accelerating Pythonic Coupled-Cluster Implementations: A Comparison Between CPUs and GPUs. Journal of chemical theory and computation 20 (3) (2024)
Rahul Chakraborty, Matheus Morato Ferreira de Moraes, Katharina Boguslawski, Artur Nowak, Julian Świerczyński, Paweł Tecmer
Toward Reliable Dipole Moments without Single Excitations: The Role of Orbital Rotations and Dynamical Correlation. Journal of chemical theory and computation 20 (11) (2024)
Rahul Chakraborty, Katharina Boguslawski, Paweł Tecmer
Static embedding with pair coupled cluster doubles based methods. Physical chemistry chemical physics : PCCP (2023)
Paweł Tecmer, Marta Gałyńska, Lena Szczuczko, Katharina Boguslawski
Geminal-Based Strategies for Modeling Large Building Blocks of Organic Electronic Materials. The journal of physical chemistry letters (2023)
Seyedehdelaram Jahani, Katharina Boguslawski, Paweł Tecmer
The relationship between structure and excited-state properties in polyanilines from geminal-based methods. RSC advances 13 (40) (2023)
Aleksandra Leszczyk, Tibor Dome, Paweł Tecmer, Dariusz Kedziera, Katharina Boguslawski
Resolving the π-assisted U-N σ f -bond formation using quantum information theory. Physical chemistry chemical physics : PCCP 24 (35) (2022)
Paweł Tecmer, Katharina Boguslawski
Geminal-based electronic structure methods in quantum chemistry. Toward a geminal model chemistry. Physical chemistry chemical physics : PCCP 24 (38) (2022)
Kenneth G Dyall, Paweł Tecmer, Ayaki Sunaga
Diffuse Basis Functions for Relativistic s and d Block Gaussian Basis Sets. Journal of chemical theory and computation 19 (1) (2022)
Kenneth G Dyall, Paweł Tecmer, Ayaki Sunaga
Diffuse Basis Functions for Relativistic s and d Block Gaussian Basis Sets. Journal of chemical theory and computation 19 (1) (2022)
Kenneth G Dyall, Paweł Tecmer, Ayaki Sunaga
Diffuse Basis Functions for Relativistic s and d Block Gaussian Basis Sets. Journal of chemical theory and computation (2022)
Artur Nowak, Paweł Tecmer, Katharina Boguslawski
Assessing the accuracy of simplified coupled cluster methods for electronic excited states in f0 actinide compounds. Physical chemistry chemical physics : PCCP 21 (35) (2019)