Tadeusz Andruniów

发表

Excited‐state minima and emission energies of retinal chromophore analogues: Performance of CASSCF and CC2 methods as compared with CASPT2

Borys Szefczyk, Dawid Grabarek, Elzbieta Walczak, 2017, J. Comput. Chem..

Is the choice of a standard zeroth‐order hamiltonian in CASPT2 ansatz optimal in calculations of excitation energies in protonated and unprotonated schiff bases of retinal?

Dawid Grabarek, Tadeusz Andruniów, Lukasz Wolanski, 2018, J. Comput. Chem..

Initial excited‐state relaxation of locked retinal protonated schiff base chromophore. An insight from coupled cluster and multireference perturbation theory calculations

Dawid Grabarek, Tadeusz Andruniów, Dawid Grabarek, 2018, J. Comput. Chem..

Electronic and structural properties of low-lying excited states of vitamin B12.

Karina Kornobis, Piotr Lodowski, Maria Jaworska, 2011, The journal of physical chemistry. B.

Time-dependent density functional theory study of cobalt corrinoids: Electronically excited states of methylcobalamin.

Piotr Lodowski, Maria Jaworska, Tadeusz Andruniów, 2008, The Journal of chemical physics.

Structure, initial excited-state relaxation, and energy storage of rhodopsin resolved at the multiconfigurational perturbation theory level

Massimo Olivucci, Nicolas Ferré, Tadeusz Andruniów, 2004, Proceedings of the National Academy of Sciences of the United States of America.

Theoretical analysis of electronic absorption spectra of vitamin B12 models

Pawel M. Kozlowski, Marek Z. Zgierski, Tadeusz Andruniów, 2001 .

Photodissociation of Co-C bond in methyl- and ethylcobalamin: an insight from TD-DFT calculations.

Piotr Lodowski, Maria Jaworska, Tadeusz Andruniów, 2009, The journal of physical chemistry. B.

Initial excited-state dynamics of an N-alkylated indanylidene-pyrroline (NAIP) rhodopsin analog.

Massimo Olivucci, Igor Schapiro, Tadeusz Andruniów, 2014, The journal of physical chemistry. B.

Assessment of Approximate Coupled-Cluster and Algebraic-Diagrammatic-Construction Methods for Ground- and Excited-State Reaction Paths and the Conical-Intersection Seam of a Retinal-Chromophore Model.

Andreas Dreuw, Massimo Olivucci, Igor Schapiro, 2015, Journal of chemical theory and computation.

Time-dependent density functional theory study of cobalt corrinoids: Electronically excited states of coenzyme B12

Piotr Lodowski, Maria Jaworska, Pawel M. Kozlowski, 2009 .

Photolysis of methylcobalamin: identification of the relevant excited states involved in Co-C bond scission.

Piotr Lodowski, Maria Jaworska, Tadeusz Andruniów, 2007, The journal of physical chemistry. B.

Electronically excited states of vitamin B12: benchmark calculations including time-dependent density functional theory and correlated ab initio methods.

Bryan M. Wong, Kenneth Ruud, Karina Kornobis, 2011, The journal of physical chemistry. A.