J. Šimunek

发表

On the variational computation of a large number of vibrational energy levels and wave functions for medium-sized molecules.

A. Császár, E. Mátyus, J. Šimunek, 2009, The Journal of chemical physics.

Doubly-occupied pair coupled cluster F12 approach.

J. Noga, M. Veis, J. Šimunek, 2020, Journal of chemical theory and computation.

Food wasting: A study among Central European four-member families

Z. Brázdová, J. Šimunek, Kateřina Vítů, 2015 .

EFFECT OF CARBADOX ON THE PASSAGE OF SULFAMETHAZINE THROUGH THE BLOOD-BRAIN BARRIER IN RAT**

J. Šimunek, A. B. Siddique, E. Hegerová, 1979 .

Structural and spectral properties of tartrato complexes of vanadium(V) from quantum chemical calculations

J. Noga, J. Šimunek, L. Krivosudský, 2015, Theoretical Chemistry Accounts.

Adolescent body image: results of Czech ELSPAC study.

J. Šimunek, J. Svancara, L. Andrýsková, 2018, Central European journal of public health.

Changes in BMI in hospitalized patients during treatment with antipsychotics, depending on gender and other factors

D. Hampel, E. Češková, J. Šimunek, 2017, International journal of psychiatry in clinical practice.

Inorganic pollutants in the indoor environment of the Moravian Library: assessment of Cd, Pb, Cu, and Zn in total suspended particles and dust using HR-CS GF-AAS

J. Šimunek, P. Coufalík, O. Zvěřina, 2020, Environmental Monitoring and Assessment.

Placental Transfer of Sulfamethazine in Mice and Rats

J. Šimunek, A. B. Siddique, E. Hegerová, 1978 .

The effect of monensin on in vitro utilization of lactate in the rumen contents.

M. Marounek, J. Šimunek, S. Bartos, 1989, Archiv fur Tierernahrung.

Production of acids from inulin by a mixed culture of rumen microorganisms.

M. Marounek, J. Šimunek, P. Březina, 1988, Archiv fur Tierernahrung.

Effect of carbadox on the placental transfer of sulphamethazine in the rat at different stages of gestation

J. Šimunek, A. B. Siddique, E. Hegerová, 1979 .

Vanadium-controlled crystallization of stereoisomers of NBu4[VO2(N-salicylidene-isoleucinato)] through epimerization.

R. Gyepes, J. Šimunek, L. Krivosudský, 2014, Chemistry.

Bimetallic copper–vanadium mandelato complexes with bpy and phen as ancillary ligands. 51V NMR spectra of vanadates in DMSO

J. Filo, R. Gyepes, J. Šimunek, 2019, Polyhedron.

The first diperoxidovanadium complex with a monodentate amine ligand: Synthesis, characterization and crystal structure of methylbenzylammonium oxido-diperoxido-methylbenzylaminevanadate monohydrate

R. Gyepes, J. Šimunek, L. Krivosudský, 2015 .

Stereospecificity in vanadium Schiff base complexes: Formation, crystallization and epimerization processes.

R. Gyepes, J. Šimunek, L. Krivosudský, 2015, Journal of inorganic biochemistry.

Stereochemistry of Vanadium Peroxido Complexes: The Case of the Quinoline-2-carboxylato Ligand.

R. Gyepes, J. Šimunek, L. Krivosudský, 2020, Inorganic chemistry.

Vanadium(v) complexes of mandelic acid

R. Gyepes, J. Šimunek, L. Krivosudský, 2019, New Journal of Chemistry.

Dinucleating role of a strong hydrogen bond in crystal structure of [N(C4H9)4]{[VO(HO2)(O2)(phen)][VO(O2)2(phen)]}·3H2O2·H2O

F. Pavelčík, J. Šimunek, Z. Ẑák, 2012 .

Synthesis, crystal structure, spectral characterization, and theoretical study of glycolato peroxido complexes of vanadium(V)

J. Noga, R. Gyepes, J. Šimunek, 2016, Structural Chemistry.

Ontogenesis of enzymatic activities in the gastrointestinal tract of young goats

M. Marounek, I. Hoza, J. Šimunek, 1995 .

Proton Affinity and Enthalpy of Formation of Formaldehyde

J. Noga, B. Braams, J. Bowman, 2009 .

Effects of central infusions of neuropeptide Y on the somatotropic axis in sheep fed on two levels of protein.

J. Polkowska, J. Šimunek, A. Gladysz, 2001, Acta neurobiologiae experimentalis.

Effect of virginiamycin and bovine somatotropin on growth, nutrient conversion and blood parameter in young female calves

M. Marounek, J. Škarda, J. Šimunek, 1996 .

The influence of regular consumption of kefir beverage on theincidence of Enterococcus faecalis in the human stool

Z. Brázdová, J. Šimunek, Danuše Lefnerová, 2007 .

Optimised Thouless expansion second-order Møller–Plesset theory

J. Noga, J. Šimunek, 2013 .

Benchmarking lattice energy of a model 1D molecular HF crystal

M. Dubecký, J. Šimunek, V. Kolesar, 2020, Theoretical Chemistry Accounts.

Solving the Independent-Particle Model via Nonunitary Transformation Based on Variational Coupled Cluster Singles.

J. Noga, J. Šimunek, 2010, Journal of chemical theory and computation.

Effect of extracellular lactate on growth of rumen lactate producers.

M. Marounek, J. Šimunek, 1994, Archiv fur Tierernahrung.

Explicitly correlated coupled cluster F12 theory with single and double excitations.

J. Noga, S. Ten-no, J. Šimunek, 2008, The Journal of chemical physics.

Effect of virginiamycin on digestibility of nutrients, blood and immunologic parameters, and quality of meat in veal calves

M. Marounek, J. Šimunek, V. Skřivanová, 1994, The Journal of Agricultural Science.

Acceleration of self‐consistent‐field convergence by combining conventional diagonalization and a diagonalization‐free procedure

Florian Weigend, Jozef Noga, Alexander Baldes, 2011, J. Comput. Chem..

Second order explicitly correlated R12 theory revisited: a second quantization framework for treatment of the operators' partitionings.

J. Noga, J. Šimunek, Stanislav Kedžuch, 2007, The Journal of chemical physics.

On the one-particle basis set relaxation in R12 based theories

J. Noga, J. Šimunek, 2009 .

Influence of redox potential on metabolism of glucose in mixed cultures of rumen microorganisms.

M. Marounek, J. Šimunek, S. Bartos, 1991, Archiv fur Tierernahrung.

Solving the Independent-Particle Model via Nonunitary Transformation Based on Variational Coupled Cluster Singles.

J. Noga, J. Šimunek, 2010, Journal of chemical theory and computation.

Effect of ionophores on in vitro caecal fermentation in rabbits

D. Dušková, M. Marounek, J. Šimunek, 1997, The Journal of Agricultural Science.