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Paweł Tecmer

nicolaus copernicus university

23H-index
75Paper Count
1.7KCitation Count
Published Papers 24
Publication Date
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Frontier Orbital Engineering in Heteroatom-Doped Prototypical Organic Dyes for Dye-Sensitized Solar Cells
errThe Journal of Physical Chemistry A
IF2.8
err2026-05-29
err0
PREAI
errAditi Singh; Ram Dhari Pandey; Subrata Jana; Prasanjit Samal; Paweł Tecmer; Szymon Ṡmiga
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Ionization Potentials at Mean-Field Computational Cost: The Extended Koopmans’ Framework for pCCD
errJournal of Chemical Theory and Computation
IF5.5
err2026-03-13
err0
PREAI
errSeyedehdelaram Jahani; Katharina Boguslawski; Paweł Tecmer
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Electron Affinities from Equation-of-Motion Frozen Pair-Type Coupled Cluster Methods and Their Dependence on Single Excitations; Molecular Orbitals; and Basis Set Sizes
errJournal of Chemical Theory and Computation
IF5.5
err2025-10-06
err0
errOAAI
errSaman Behjou; Paweł Tecmer; Katharina Boguslawski
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Expectation Value-pCCD-Based Methods for Single-Electron Properties
errThe Journal of Physical Chemistry A
IF0
err2025-07-16
err0
errOAAI
errRahul Chakraborty; Somayeh Ahmadkhani; Julian Świerczyński; Katharina Boguslawski; Paweł Tecmer
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Frozen-Pair-Type pCCD-Based Methods and Their Double Ionization Variants to Predict Properties of Prototypical BN-Doped Light Emitters
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2025-05-14
err0
errOAAI
errPandey, Ram Dhari; de Moraes, Matheus Morato F.; Boguslawski, Katharina; Tecmer, Pawel
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Simple and efficient computational strategies for calculating orbital energies and pair-orbital energies from pCCD-based methods
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2025-05-12
err0
errOAAI
errJahani, Seyedehdelaram; Ahmadkhani, Somayeh; Boguslawski, Katharina; Tecmer, Pawel
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Domain-Based Charge-Transfer Decomposition and Its Application to Explore the Charge-Transfer Character in Prototypical Dyes
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2025-04-29
err0
errOAAI
errSzczuczko, Lena; Galynska, Marta; Kriebel, Maximilian H.; Tecmer, Pawel
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Linear Response pCCD-Based Methods: LR-pCCD and LR-pCCD plus S Approaches for the Efficient and Reliable Modeling of Excited State Properties
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2024-11-20
err1
errOAAI
errAhmadkhani, Somayeh; Boguslawski, Katharina; Tecmer, Pawel
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Toward Reliable Dipole Moments without Single Excitations: The Role of Orbital Rotations and Dynamical Correlation
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2024-05-29
err1
errOAAI
errChakraborty, Rahul; de Moraes, Matheus Morato F.; Boguslawski, Katharina; Nowak, Artur; Swierczynnski, Julian; Tecmer, Pawel
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PyBEST: Improved functionality and enhanced performance
errCOMPUTER PHYSICS COMMUNICATIONS
IF3.4
err2024-04-01
err8
errOAAI
errBoguslawski, Katharina; Brzek, Filip; Chakraborty, Rahul; Cieslak, Kacper; Jahani, Seyedehdelaram; Leszczyk, Aleksandra; Nowak, Artur; Sujkowski, Emil; Swierczynski, Julian; Ahmadkhani, Somayeh; Kedziera, Dariusz; Kriebel, Maximilian H.; Zuchowski, Piotr Szymon; Tecmer, Pawel
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Accelerating Pythonic Coupled-Cluster Implementations: A Comparison Between CPUs and GPUs
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2024-02-02
err2
errOAAI
errKriebel, Maximilian H.; Tecmer, Pawel; Galynska, Marta; Leszczyk, Aleksandra; Boguslawski, Katharina
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Diffuse Basis Functions for Relativistic s and d Block Gaussian Basis Sets
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2022-12-14
err11
PREAI
errDyall, Kenneth G.; Tecmer, Pawel; Sunaga, Ayaki
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Pythonic Black-box Electronic Structure Tool (PyBEST). An open-source Python platform for electronic structure calculations at the interface between chemistry and physics
errCOMPUTER PHYSICS COMMUNICATIONS
IF3.4
err2021-07-01
err22
errOAAI
errBoguslawski, Katharina; Leszczyk, Aleksandra; Nowak, Artur; Brzek, Filip; Zuchowski, Piotr Szymon; Kedziera, Dariusz; Tecmer, Pawel
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Multi-reference ab initio calculations of Hg spectral data and analysis of magic and zero-magic wavelengths
errOPTICS EXPRESS
IF3.3
err2021-03-05
err4
errOAAI
errGogyan, Anahit; Tecmer, Pawel; Zawada, Michal
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Benchmarking the Accuracy of Seniority-Zero Wave Function Methods for Noncovalent Interactions
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2019-05-28
err20
errOAAI
errBrzek, Filip; Boguslawski, Katharina; Tecmer, Pawel; Zuchowski, Piotr Szymon
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Benchmark of Dynamic Electron Correlation Models for Seniority-Zero Wave Functions and Their Application to Thermochemistry
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2017-10-03
err32
errOAAI
errBoguslawski, Katharina; Tecmer, Pawel
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Analysis of two-orbital correlations in wave functions restricted to electron-pair states
errPHYSICAL REVIEW B
IF3.7
err2016-10-14
err35
errOAAI
errBoguslawski, Katharina; Tecmer, Pawel; Legeza, Ors
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Nonvariational Orbital Optimization Techniques for the AP1roG Wave Function
errJOURNAL OF CHEMICAL THEORY AND COMPUTATION
IF5.5
err2014-10-13
err72
PREAI
errBoguslawski, Katharina; Tecmer, Pawel; Bultinck, Patrick; De Baerdemacker, Stijn; Van Neck, Dimitri; Ayers, Paul W.
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Communication: Relativistic Fock-space coupled cluster study of small building blocks of larger uranium complexes
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2014-07-31
err30
errOAAI
errTecmer, Pawel; Gomes, Andre Severo Pereira; Knecht, Stefan; Visscher, Lucas
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Projected seniority-two orbital optimization of the antisymmetric product of one-reference orbital geminal
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2014-06-06
err82
errOAAI
errBoguslawski, Katharina; Tecmer, Pawel; Limacher, Peter A.; Johnson, Paul A.; Ayers, Paul W.; Bultinck, Patrick; De Baerdemacker, Stijn; Van Neck, Dimitri
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Research Directions

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Co-authors
Cooperation Journals
M
Markus Reiher
H-index: 82 · Papers: 663
P
Paul W. Ayers
H-index: 76 · Papers: 518
L
Lucas Visscher
H-index: 60 · Papers: 279
K
Karol Kowalski
H-index: 53 · Papers: 328
P
Patrick Bultinck
H-index: 53 · Papers: 378
View more