Z. Latajka

发表

Effects of xenon insertion into hydrogen bromide. Comparison of the electronic structure of the HBr···CO2 and HXeBr···CO2 complexes using quantum chemical topology methods: electron localization function, atoms in molecules and symmetry adapted perturbation theory.

E. Makarewicz, A. Gordon, K. Mierzwicki, 2014, The journal of physical chemistry. A.

On the Intramolecular Hydrogen Bond in Solution: Car-Parrinello and Path Integral Molecular Dynamics Perspective.

C. Perrin, Z. Latajka, P. Dopieralski, 2011, Journal of chemical theory and computation.

Critical analysis of the calculated frequency shifts of hydrogen-bonded complexes

A. Dkhissi, B. Silvi, Z. Latajka, 1999 .

On the multiple BO bonding using the topological analysis of Electron Localisation Function (ELF)

A. Gordon, Z. Latajka, S. Berski, 2015 .

On the multiple B–N bonding in boron compounds using the topological analysis of electron localization function (ELF)

A. Gordon, Z. Latajka, S. Berski, 2011 .

2-(Hydroxyimino)propanohydroxamic acid, a new effective ligand for aluminium

H. Kozłowski, I. Fritsky, Z. Latajka, 2000 .

Structure, energetics, and vibrational spectrum of H2O-X− (X = F, Cl) complexes

Z. Latajka, 1992 .

Basis sets for molecular interactionsPart 4. Energy decomposition analysis

Z. Latajka, 1991 .

Basis sets for molecular interactions

Z. Latajka, 1990 .

Structure, Energetics and Vibrational Spectra of Dimers, Trimers, and Tetramers of HX (X = Cl, Br, I)

S. Scheiner, Z. Latajka, 1997 .

Dominant role of C-Br...N halogen bond in molecular self-organization. Crystallographic and quantum-chemical study of schiff-base-containing triazoles

Z. Ciunik, Z. Latajka, S. Berski, 2004 .

Ab initio calculation of the inversion barrier in the trichloromethyl radical

Z. Latajka, H. Ratajczak, J. Rudziǹski, 1990 .

Electron localization function studies of the nature of binding in neutral rare-gas containing hydrides: HKrCN, HKrNC, HXeCN, HXeNC, HXeOH, and HXeSH

B. Silvi, Z. Latajka, S. Berski, 2001 .

Structure and energetics of SO2X−(X = F, Cl, Br, and I) complexes

Z. Latajka, H. Ratajczak, S. Wasif, 1995 .

Ab initio and CNDO/2 molecular orbital calculations of dewar and valene structures of pyrrole and furan

W. J. Orville-Thomas, E. Ratajczak, Z. Latajka, 1981 .

Electronic structure of the CF3 radical by the SW Xα method

Z. Latajka, H. Ratajczak, J. Moc, 1986 .

Matrix-isolation and computational study of the HXeY⋯H2O complexes (Y = Cl, Br, and I).

M. Räsänen, L. Khriachtchev, Z. Latajka, 2014, The Journal of chemical physics.

Experimental and computational study of the HXeI···HY complexes (Y = Br and I).

M. Räsänen, L. Khriachtchev, Z. Latajka, 2013, The Journal of chemical physics.

High kinetic stability of HXeBr upon interaction with carbon dioxide: HXeBr···CO2 complex in a xenon matrix and HXeBr in a carbon dioxide matrix.

M. Räsänen, L. Khriachtchev, Z. Latajka, 2012, The journal of physical chemistry. A.

The contribution of dispersion to H-bonds between hydrides of first and second-row atoms

S. Scheiner, Z. Latajka, M. Szczęśniak, 1986 .

Ab initio study of FH–PH3 and ClH–PH3 including the effects of electron correlation

S. Scheiner, Z. Latajka, 1984 .

A study of the Raman spectra of alkanes in the Fermi-resonance region

A. Leipertz, Z. Latajka, H. Ratajczak, 2004 .

A mechanism of the 1,3‐dipolar cycloaddition between the hydrogen nitryl HNO2 and acetylene HCCH: The electron localization function study on evolution of the chemical bonds

Z. Latajka, S. Berski, 2011 .

Calculation of electronic affinity and vertical detachment energy of the water dimer complex using the density functional theory

B. Silvi, C. Desfrançois, Z. Latajka, 1998 .

Structure, energetics, and vibrational spectrum of H3N..HOH.

S. Scheiner, Z. Latajka, 1990 .

Influence of Electron Correlation Effects on Calculated Properties and Vibrational Spectra of FF...NH3 and FCl...NH3 charge transfer complexes

S. Scheiner, Z. Latajka, H. Ratajczak, 1996 .

AM1 and ab initio studies of aminomethylphosphonic acid

S. Scheiner, Z. Latajka, H. Ratajczak, 1991 .

Ab initio studies of hydrogen-bonded complexes between formic acid or methylacetate and HF or HCl

Z. Latajka, H. Ratajczak, T. Zeegers-Huyskens, 1988 .

Electron localization function study on the chemical bonding in a real space for tetrahedrane, cubane, adamantane, and dodecahedrane and their perfluorinated derivatives and radical anions.

A. Gordon, Z. Latajka, S. Berski, 2014, The journal of physical chemistry. A.

FONO: a difficult case for theory. The ELF and ELI-D topological studies on the chemical bonding using correlated wavefunctions.

A. Gordon, Z. Latajka, S. Berski, 2013, The Journal of chemical physics.

The protocovalent NO bond: Quantum chemical topology (QCT of ELF and ELI-D) study on the bonding in the nitrous acid HONO and its relevancy to the experiment

K. Mierzwicki, Z. Latajka, S. Berski, 2008 .

Matrix isolation and DFT studies of nitrous acid complexes with nitrogen dioxide

Z. Latajka, R. Wieczorek, A. Olbert-Majkut, 2002 .

Ab initio calculations and matrix infrared spectra of the nitrous acid complexes with HF and HCl

Z. Latajka, R. Wieczorek, K. Tokhadze, 1999 .

Properties of strong hydrogen‐bonded systems. II. Ab initioSCF‐MO study of the hydrogen bond between nitric acid and ammonia

W. J. Orville-Thomas, Z. Latajka, H. Ratajczak, 1980 .

Theoretical study on the structures and vibrational spectra of the H2SO4-(CO2)x (x = 1, 2) hydrogen bonded complexes

Z. Latajka, A. Bieńko, 2003 .

Density functional studies of 1:1 and 1:2 sulfuric acid complexes with carbon monoxide

Z. Latajka, A. Bieńko, 2002 .

Molecular orbital calculations for the HCl crystal

Z. Latajka, H. Ratajczak, 1979 .

Theoretical vibrational study of FX...NH3 (X=H, D, Li) complexes

S. Scheiner, Z. Latajka, H. Ratajczak, 1991 .

Comparison of lithium and hydrogen bonds in (X···Li···X)− and (X···H···X)− (XF, Cl and Br) complexes: Topological analysis of electron localization function

Z. Latajka, S. Berski, 2002 .

Hydroperoxy radical as hydrogen bond donor: NH3–HOO complex – ab initio and topological study

Z. Latajka, A. Bil, 2005 .

About the Aromaticity of symm-Triaminotrinitrobenzene.

O. Shishkin, Z. Latajka, I. Omelchenko, 2019, The journal of physical chemistry. A.

Vibrational calculations for the H2O … CO complex

Z. Latajka, J. Lundell, 2008 .

Interaction energy decomposition analysis for formic acid complexes with argon and krypton atoms

Z. Latajka, P. Wawrzyniak, J. Panek, 2006 .

Basis set superposition error in N-body clusters

K. Mierzwicki, Z. Latajka, 2003 .

Hyperpolarizabilities of some model hydrogen-bonded complexes: PM3 and ab initio studies

D. Xue, Z. Latajka, H. Ratajczak, 2009 .

Theoretical and experimental studies of the kinetics of the reaction of 1‐chloropropane and fully deuterated 1‐chloropropane with atomic chlorine

Z. Latajka, A. Dryś, D. Sarzyński, 2021, International Journal of Chemical Kinetics.

Experimental and theoretical studies of the reactions of chlorine atoms with 1,2-dichloroethane and 1,2-dichloroethane-d4 in the gas phase. The kinetics of hydrogen atom abstraction from the –CH2Cl group in chloroethane and 1,2-dichloroethane

Z. Latajka, J. Jodkowski, A. Gola, 2014 .

Experimental and Theoretical Study of the Kinetics and Mechanism of the Reaction of Chlorine Atoms with CH3CHClCH3 and CD3CDClCD3.

Z. Latajka, D. Sarzyński, Łukasz Fojcik, 2018, The journal of physical chemistry. A.

Spectroscopic and computational characterization of the HCO···H2O complex.

Qian Cao, M. Räsänen, L. Khriachtchev, 2013, The journal of physical chemistry. A.

Theoretical study of the CCl3 radical

Z. Latajka, H. Ratajczak, J. Moc, 1986 .

Energetics of proton transfer between carbon atoms (H3CH CH3)

S. Scheiner, Z. Latajka, 1986 .

On the reliability of SCF ab initio calculations of vibrational frequencies and intensities of hydrogen-bonded systems

Z. Latajka, W. Person, H. Ratajczak, 1989 .

Site-Site Function and Successive Reaction Counterpoise Calculation of Basis Set Superposition Error for Proton Transfer

S. Scheiner, Z. Latajka, G. Chałasiński, 1995 .

Ab initio UHF and SWXα study of the GeF3 and SiF3 radicals

Z. Latajka, H. Ratajczak, J. Moc, 1988 .

Theoretical study of the geometry of GeH3 and electronic structure of SiH3 and GeH3

Z. Latajka, H. Ratajczak, J. Moc, 1987 .

Geometry and electronic structure of CBr3. Comparison with CF3 and CCl3

Z. Latajka, H. Ratajczak, J. Moc, 1986 .

An ab initio calculation of the infrared spectrum and tautomerism of guanine

K. Morokuma, Z. Latajka, W. Person, 1986 .

Theoretical and infrared matrix isolation studies of the CF3COOH-N2 system

Z. Latajka, H. Ratajczak, Z. Mielke, 1985 .

Ab initio characterization of the xenon dihydride dimer – (HXeH)2

Z. Latajka, S. Berski, J. Lundell, 2003 .

Bonding in hypohalous acids HOX (X=F, Cl, Br, and I) from the topological analysis of the electron localization function

J. Leszczynski, B. Silvi, Z. Latajka, 1999 .

Quantum chemical study of the hydrogen-bonded HXeOH–H2O complex

Z. Latajka, S. Berski, A. Lignell, 2006 .

A density functional study of the xenon dihydride–water complex

Z. Latajka, S. Berski, J. Lundell, 2000 .

Dihydrogen-bonded complexes of xenon dihydride with water: Ab initio calculations and topological analysis of electron localisation function (ELF)

Z. Latajka, S. Berski, J. Lundell, 2000 .

Car-Parrinello and path integral molecular dynamics study of the intramolecular hydrogen bonds in the crystals of benzoylacetone and dideuterobenzoylacetone.

Z. Latajka, P. Durlak, 2014, Physical chemistry chemical physics : PCCP.

Investigations of the hydrogen bond in the crystals of tropolone and thiotropolone via car‐parrinello and path integral molecular dynamics

Piotr Durlak, Zdzislaw Latajka, Z. Latajka, 2018, J. Comput. Chem..

How the α-hydroxymethylserine residue stabilizes oligopeptide complexes with nickel(II) and copper(II) ions

P. Młynarz, H. Kozłowski, Z. Latajka, 2000 .

Proton transfer dynamics in the propionic acid dimer from path integral molecular dynamics calculations

Z. Latajka, P. Durlak, 2011, Journal of molecular modeling.

The first structurally characterized nonorganometallic titanium(III) alkoxo-bridged dinuclear complexes.

K. Mierzwicki, Z. Latajka, L. Jerzykiewicz, 2003, Inorganic chemistry.

Combined matrix isolation IR spectroscopic and ab initio quantum chemical study of the molecular structure of aminomethylphosphinic acid

Z. Latajka, H. Ratajczak, I. Reva, 1999 .

Describing the chemical bonding in C70 and C70O3 – A quantum chemical topology study

J. Hutter, C. Morrison, Z. Latajka, 2014 .

Generalized relativistic effective core potential: Gaussian expansions of potentials and pseudospinors for atoms Hg through Rn

Z. Latajka, A. Titov, N. Mosyagin, 1997 .

Cadmium(II) and nickel(II) complexes of benziporphyrins. A study of weak intramolecular metal-arene interactions.

Z. Latajka, M. Stępień, J. Panek, 2004, Journal of the American Chemical Society.

Hydration of NaHCO3, KHCO3, (HCO3-)2, HCO3- and CO32- from molecular dynamics simulation and speed of sound measurements

Z. Latajka, P. Dopieralski, I. Olovsson, 2011 .

Dielectric relaxation and molecular conformational energy of some arylazo benzothiazine derivatives

A. Jurlewicz, Z. Latajka, R. Wieczorek, 2000 .

13C NMR investigations of phenol–triethylamine complexes: Influence of hydrogen bond interaction on the electronic structure of the aliphatic chain

Z. Latajka, H. Ratajczak, M. Ilczyszyn, 1984 .

Pseudopotential periodic hartree-fock investigation of potassium dihydrogen phosphate

B. Silvi, Z. Latajka, H. Ratajczak, 1993 .

Anharmonic interactions and infrared bandshape of the hydrogen bond vibration of potassium hydrogen (deuterium) maleate crystals

J. Baran, Z. Latajka, H. Ratajczak, 2008 .

Theoretical study of the electronic spectra of the hydrogen maleate ion by the CNDO/S CI method

Z. Latajka, H. Ratajczak, 1977 .

Proton transfer in strongly hydrogen-bonded molecular complexes: matrix effects

M. Biczysko, Z. Latajka, A. Barnes, 2002 .

Correlation between interaction energy and shift of the carbonyl stretching frequency

S. Scheiner, Z. Latajka, 1990 .

Ab initio studies of hydrogen-bonded complexes between uracil and HCl

S. Scheiner, Z. Latajka, H. Ratajczak, 1991 .

Vibrational dynamics of medium strength hydrogen bonds: Fourier transform infrared spectra and band contour analysis of the DF stretching region of (CH2)2S-DF.

Z. Latajka, P. Soulard, P. Asselin, 2004, The Journal of chemical physics.

New theoretical interpretation of acetone-FX (X=H,D) infrared spectrum in the gas phase

Z. Latajka, Y. Bouteiller, 1994 .

Structure, Energetics, and Vibrational Spectra of H-Bonded Systems. Dimers and Trimers of HF and HCl

S. Scheiner, Z. Latajka, 1988 .

The examination of the hydroperoxy radical and its closed-shell “analogues” by means of topological methods of quantum chemistry: AIM and ELF

Z. Latajka, A. Bil, 2004 .

The Proton Position in Amine-HX (X=Br, I) Complexes

S. Scheiner, Z. Latajka, H. Ratajczak, 1992 .

Proton and lithium cation affinities calculated with floating orbital geometry optimization (FOGO)

Z. Latajka, H. Huber, 1983 .

Proton-transfer dynamics in the (HCO3-)2 dimer of KHCO3 from Car-Parrinello and path-integrals molecular dynamics calculations.

Z. Latajka, P. Dopieralski, I. Olovsson, 2010, Acta crystallographica. Section B, Structural science.

CNDO/2 molecular orbital calculations on the complexes formed between methyllithium and trimethylaluminium with aliphatic amines

Z. Latajka, H. Ratajczak, K. Romanowska, 1977 .

The dimerization shift of the OH-stretching fundamentals of the water dimer

Z. Latajka, O. Ventura, K. Irving, 1994 .

Theoretical infrared spectrum and revised assignment for para-nitrophenol. Density functional theory studies

D. Michalska, D. Bieńko, Z. Latajka, 1999 .

Structural and vibrational study of a novel nonlinear optical material: 3-nitrobenzoic acid hydrazide

S. Debrus, M. May, J. Baran, 2001 .

Fermi resonance and strong anharmonic effects in the absorption spectra of the ν-OH (ν-OD) vibration of solid H- and D-benzoic acid

J. Baran, Z. Latajka, H. Ratajczak, 2009 .

Hyperpolarizabilities of hydrogen-bonded complexes of phenol derivatives with ammonia: PM3 and ab initio studies

Z. Latajka, H. Ratajczak, Grzegorz Gajewski, 2008 .

Hyperpolarizabilities of strongly hydrogen-bonded molecular complexes: PM3 and ab initio studies

Z. Latajka, H. Ratajczak, Grzegorz Gajewski, 2007 .

Theoretical interpretation of acetone–HF infrared spectrum in the gas phase

Z. Latajka, Y. Bouteiller, 1992 .

Spectroscopic and theoretical studies of the OCO⋯HF complex in pressurized gases

A. I. Uspensky, Z. Latajka, H. Ratajczak, 1996 .

Topological aspects of protonation and hydrogen bonding: the dihydrogen bond case

B. Silvi, Z. Latajka, S. Berski, 2000 .

Solvent Effect on Hydrogen Bonded Ammonia-hydrogen Halide Complexes: Continuum Medium Versus Cluster Models

Agnieszka Abkowicz-Bienko, Malgorzata Biczysko, Zdzislaw Latajka, 2000, Comput. Chem..

at]Infrared matrix isolation and CNDO/2 studies of complexes between trifluoroacetic acid and hydrogen halides

Z. Latajka, H. Ratajczak, Z. Mielke, 1982 .

Vibrational dynamics of the hydrogen bonded complexes (CH2)2O-HF and -DF investigated by combined jet- and cell-Fourier transform infrared spectroscopy.

Z. Latajka, P. Soulard, P. Asselin, 2005, Physical chemistry chemical physics : PCCP.

Proton Transfer Dynamics in Crystalline Maleic Acid from Molecular Dynamics Calculations.

Z. Latajka, P. Dopieralski, I. Olovsson, 2010, Journal of chemical theory and computation.

First-principles investigation of isomerization by proton transfer in beta-fumaric acid crystal.

Z. Latajka, P. Dopieralski, J. Panek, 2009, The Journal of chemical physics.

On the difference between hydrogen fluoride and hydrogen chloride crystals

Z. Latajka, S. Berski, 1998 .

Application of density functional methods for the study of hydrogen‐bonded systems: The hydrogen fluoride dimer

Z. Latajka, Zdzisław Latajka, Y. Bouteiller, 1994 .

Theoretical Study on Noncovalent Interactions in the Carbon Nanotube–Formic Acid Dimer System

C. Hättig, Z. Latajka, Piotr Okrasiński, 2014 .

A Car-Parrinello and path integral molecular dynamics study of the intramolecular lithium bond in the lithium 2-pyridyl-N-oxide acetate.

Z. Latajka, S. Berski, P. Durlak, 2009, The Journal of chemical physics.

Ab initio study of interactions between methanol and nitrogen or carbon monoxide

W. J. Orville-Thomas, Z. Latajka, H. Ratajczak, 1989 .

Localized molecular orbital studies of complexes formed between methyl derivatives of ethylene with hydrogen fluoride and fluorine

Z. Latajka, H. Ratajczak, Ya. M. Kimel'fel'd, 1980 .

HF-ClF: minima on the 4-31G and 4-31G* energy hypersurfaces and thermodynamics of formation

P. Hobza, Z. Latajka, M. Szczęśniak, 1981 .

Critical Assessment of Density Functional Methods for Study of Proton Transfer Processes (FHF)

Steve Scheiner, S. Scheiner, Z. Latajka, 1995 .

Density functional study of the Xe2H3+ cation

Z. Latajka, S. Berski, J. Lundell, 1999 .

The Potential Energy Surface and Equilibrium Geometry of Ar··PH3

S. Scheiner, Z. Latajka, 1989 .

Role of polarization functions in cation binding. H3NLi+ and H2OLi+

S. Scheiner, Z. Latajka, 1985 .

Improvement of polarized double-zeta basis sets for molecular interactions. Complexes of NH3, OH2, and FH with H+ and Li+

S. Scheiner, Z. Latajka, 1984 .

S. Scheiner, Z. Latajka, 1991 .

Reaction of atomic hydrogen with formic acid.

Qian Cao, M. Räsänen, L. Khriachtchev, 2014, Physical chemistry chemical physics : PCCP.

Ab initio study of proton transfer between methylnitroamine and trimethylamine

Z. Latajka, H. Ratajczak, Y. Bouteiller, 1992 .

On Three-Electron Bonds and Hydrogen Bonds in the Open-Shell Complexes [H2X2]+ for X = F, Cl, and Br†

Zdzislaw Latajka, Slawomir Berski, Andrzej Bil, 2007, J. Chem. Inf. Model..

Ab initio comparison of H bonds and Li bonds. Complexes of LiF, LiCl, HF, and HCl with NH3

S. Scheiner, Z. Latajka, 1984 .

Basis Set Superposition Error in Proton Transfer Potentials

S. Scheiner, Z. Latajka, G. Chałasiński, 1992 .

DFT calculations of HRgX (Rg = rare gas; X = halogen) molecules

Z. Latajka, J. Panek, J. Lundell, 2002 .

Quantum chemical calculations on FXeSiF

Jan Lundell, Z. Latajka, Jarosław J. Panek, 2001 .

The Potential Energy Surface of (NH3)2

S. Scheiner, Z. Latajka, 1986 .

Proton Transfer in the Ground and First Excited Triplet States of Malonaldehyde

S. Scheiner, Z. Latajka, 1992 .

Dissection of basis set superposition error at SCF and correlated levels: HF dimer

S. Scheiner, Z. Latajka, 1989 .

Three-dimensional spatial characteristics of primary and secondary basis set superposition error

S. Scheiner, Z. Latajka, 1987 .

Primary and secondary basis set superposition error at the SCF and MP2 levels. H3N‐‐Li+ and H2O‐‐Li+

S. Scheiner, Z. Latajka, 1987 .

Reversal of the usual spectral shift of haloforms in some hydrogen-bonded complexes

Z. Latajka, I. Boldeskul, I. F. Tsymbal, 1997 .

Density functional studies of hydrogen-bonded systems

Z. Latajka, J. Lundell, 2001 .

Theoretical study of the H2O2CO hydrogen-bonded ternary complexes

M. Räsänen, Z. Latajka, J. Lundell, 1994 .

Effects of basis set and electron correlation on the calculated properties of the ammonia dimer

S. Scheiner, Z. Latajka, 1984 .

Density functional study of the H3NCl2 system—the importance of Hartree-Fock exchange in density functional methods

Z. Latajka, S. Berski, 1996 .

Properties of strong hydrogen-bonded systems: The formation of hydrogen-bonded ion pair in amine·HCL systems

W. J. Orville-Thomas, Z. Latajka, M. Szczęśniak, 1980 .

Theoretical studies of lithium bonding in lithium chloride/aliphatic amine complexes

W. J. Orville-Thomas, P. Piecuch, C. Rao, 1985 .

HF-HCl: stationary points on the scf energy hypersurface and thermodynamics of formation

P. Hobza, Z. Latajka, M. Szczęśniak, 1980 .

Nonadditivity of interaction in Li(NH3)n and Li(NH3)n+ (n=1–4) clusters

K. Mierzwicki, Z. Latajka, 2001 .

13C chemical shifts of phenol derivatives. A correlation with electronic structure

Z. Latajka, H. Ratajczak, M. Ilczyszyn, 1980 .

13C NMR investigations of phenol–triethylamine complexes: The influence of hydrogen bond interaction on the electronic structure of phenols

Z. Latajka, H. Ratajczak, M. Ilczyszyn, 1981 .

Rotation around the glycosidic bond as driving force of proton transfer in protonated 2′-deoxyriboadenosine monophosphate (dAMP)

O. Shishkin, Z. Latajka, P. Dopieralski, 2010 .

Car-Parrinello and path integral molecular dynamics study of the hydrogen bonds in 2-acetyl-1,8-dihydroxy-3,6-dimethylnaphthalene

Z. Latajka, P. Durlak, 2010 .

Car–Parrinello and path integral molecular dynamics study of the intramolecular hydrogen bond in the novel class of anionic H-chelates: 6-Nitro-2,3-dipyrrol-2-ylquinoxaline anion

Z. Latajka, P. Durlak, 2009 .

Impact of Deuteration and Temperature on Furan Ring Dynamics

Z. Latajka, I. Omelchenko, P. Dopieralski, 2021, Molecules.

On the Role of the Basis Set and Electron Correlation in the Description of Stacking Interactions

Zdzislaw Latajka, Slawomir Berski, Z. Latajka, 1997, Comput. Chem..

Electron localization function and electron localizability indicator applied to study the bonding in the peroxynitrous acid HOONO

Zdzislaw Latajka, Slawomir Berski, Agnieszka J. Gordon, 2011, J. Comput. Chem..

Theoretical study on the polarizability and hyperpolarizability of hydrogen bonded complexes of nitropyridines with hydrogen fluoride

K. Mierzwicki, Z. Latajka, H. Ratajczak, 2009 .

Density Functional Study of Hydrogen-Bonded Systems: The Water−Carbon Monoxide Complex

Jan Lundell, Z. Latajka, Zdzisław Latajka, 1997 .

Ab Initio and Quantum Chemical Topology studies on the isomerization of HONO to HNO2. Effect of the basis set in QCT

Zdzislaw Latajka, Slawomir Berski, Agnieszka J. Gordon, 2010, J. Comput. Chem..

Protocovalent N–O bonding in methyl nitrite (CH3ONO) and ethyl nitrite (C2H5ONO). Topological analysis of the electron localization function (ELF) and electron localizability indicator (ELI-D) functions

A. Gordon, Z. Latajka, S. Berski, 2010 .

Quantum chemical topology: The electronic structure of the alkaline nitrites MONO (M = Li, Na, K) studied by means of topological analysis of the electron localization function

Z. Latajka, S. Berski, 2009 .

Hydrogen detachment driven by a repulsive 1πσ* state - an electron localization function study of 3-amino-1,2,4-triazole.

M. Biczysko, Z. Latajka, A. Bil, 2018, Physical chemistry chemical physics : PCCP.

Kinetics of proton transfer in (H3CH..CH3)

S. Scheiner, Z. Latajka, 1987 .

The nature of halogen bond in model OC∙∙∙XY systems from the energy decomposition analysis perspective

Z. Latajka, Łukasz Fojcik, 2021, Computational and Theoretical Chemistry.

New aspects of weak CH⋯π bonds: intermolecular interactions between alicyclic and aromatic rings in crystals of small compounds, peptides and proteins

Z. Ciunik, J. Leszczynski, Z. Latajka, 1998 .

A theoretical study of NO2 complexes with aluminium and gallium based on topological analysis of electron density and electron localization function

Z. Latajka, J. Panek, 2000 .

Basis sets for molecular interactions. 2. Application to H3NHF, H3NHOH, H2OHF, (NH3)2, and H3CHOH2

S. Scheiner, Z. Latajka, 1987 .

The influence of water molecules on the proton position in H3N–HX (X=F, Cl, Br) complexes

M. Biczysko, Z. Latajka, 1999 .

The hydroperoxy radical and its closed-shell 'analogues': ab initio investigations

Z. Latajka, A. Bil, 2004 .

Dynamical Nonplanarity of Benzene. Evidences from the Car–Parrinello Molecular Dynamics Study

J. Leszczynski, O. Shishkin, Z. Latajka, 2011 .

Quantum chemical topology study on the electronic structure of cis- and trans-FONO.

A. Gordon, Z. Latajka, S. Berski, 2010, The Journal of chemical physics.

Spectroscopic and Theoretical Studies of the Complexes between Nitrous Acid and Ammonia

E. Ratajczak, Z. Latajka, Z. Mielke, 1996 .

Infrared matrix isolation and theoretical studies of SO2–HNO3 and SO2–HONO systems

Z. Latajka, R. Wieczorek, M. Wierzejewska, 1998 .

Matrix isolation FTIR and ab initio study of complexes between formic acid and nitrogen

M. Räsänen, Z. Latajka, J. Lundell, 1994 .

Car-Parrinello and path integral molecular dynamics study of the hydrogen bond in the acetic acid dimer in the gas phase

Z. Latajka, S. Berski, P. Durlak, 2011, Journal of molecular modeling.

Car–Parrinello molecular dynamics and density functional theory simulations of infrared spectra for acetic acid monomers and cyclic dimers

Z. Latajka, P. Durlak, 2009 .

Car-Parrinello and path integral molecular dynamics study of the hydrogen bond in the chloroacetic acid dimer system.

C. Morrison, Z. Latajka, D. Middlemiss, 2007, The Journal of chemical physics.

Theoretical Study of Aluminum and Gallium Atom Complexes with CO2, CS2, and COS

Z. Latajka, J. Panek, 1999 .

Matrix Infrared Spectra and ab Initio Calculations of the Nitrous Acid Complexes with N2 and CO

Z. Latajka, K. Tokhadze, Z. Mielke, 1996 .

A study of intermolecular interaction in the polymer of monofluorosilane by the CNDO/2 method

Z. Latajka, H. Ratajczak, 1979 .

C(70) oxides and ozonides and the mechanism of ozonolysis on the fullerene surface. A theoretical study.

C. Morrison, Z. Latajka, A. Bil, 2009, The journal of physical chemistry. A.

Basis set superposition error in calculations of nonadditive effects in Li(NH3)n and Li(NH3)n+ (n=1–4) clusters

K. Mierzwicki, Z. Latajka, 2000 .

Molecular Modeling Study of Leflunomide and Its Active Metabolite Analogues

Zdzislaw Latajka, Jaroslaw J. Panek, Aneta Jezierska-Mazzarello, 2005, J. Chem. Inf. Model..

Kinetics and thermochemistry of the reversible gas phase reaction HONO+NH3⇌H3H-HONO studied by infrared diode laser spectroscopy

E. Ratajczak, Z. Latajka, P. Pagsberg, 1994 .

The nature of the Au–Rg bond in the [AuRg 4 ] 2+ (Rg=Ar, Kr and Xe) molecules

J. Andrés, Z. Latajka, S. Berski, 2002 .

Nature of chemical bonds in MCCH (M=Li, Na, K) based on the topological analysis of electron localisation function (ELF) and electron density

K. Mierzwicki, Z. Latajka, S. Berski, 2000 .

The Nature of Binding in HRgY Compounds (Rg = Ar, Kr, Xe; Y = F, Cl) Based on the Topological Analysis of the Electron Localisation Function (ELF)

B. Silvi, Z. Latajka, S. Berski, 2001 .

Ab Initio Molecular Dynamics Study of the Very Short O-H···O Hydrogen Bonds in the Condensed Phases.

Z. Latajka, P. Durlak, 2013, Journal of chemical theory and computation.

CNDO/2 molecular orbital calculations on the complexes formed between dimethylberyllium and aliphatic amines

Z. Latajka, H. Ratajczak, K. Romanowska, 1977 .

Structural analysis and sheep pituitary receptor binding of GnRH and its complexes with metal ions.

P. Młynarz, H. Kozłowski, Z. Latajka, 2003, Journal of inorganic biochemistry.

Density Functional, Hartree−Fock, and MP2 Studies on the Vibrational Spectrum of Phenol

Danuta Michalska, D. Michalska, D. Bieńko, 1996 .

Complexes between formic acid and carbon monoxide : an ab initio investigation

M. Räsänen, Z. Latajka, J. Lundell, 1993 .

Density functional theory applied to proton-transfer systems. A numerical test

C. Mijoule, Z. Latajka, D. Borgis, 1993 .

The proton position in hydrogen halide-amine complexes. BrH-NH3 and BrH-NH2CH3

S. Scheiner, Z. Latajka, H. Ratajczak, 1987 .

Low barrier hydrogen bond in protonated proton sponge. X-ray diffraction, infrared, and theoretical ab initio and density functional theory studies

L. Sobczyk, E. Grech, Z. Latajka, 2003 .

Reinvestigation of spectroscopic properties for ammonia–hydrogen halide complexes from Car–Parrinello Molecular Dynamics

M. Biczysko, Z. Latajka, Paweł T. Panek, 2011 .

Possible gas-phase ion pairs in amine-HCl complexes. An ab initio theoretical study

K. Morokuma, S. Sakai, Z. Latajka, 1984 .

Basis sets for molecular interactions. 1. Construction and tests on (HF)2 and (H2O)2

S. Scheiner, Z. Latajka, 1987 .

Investigations of the very short hydrogen bond in the crystal of nitromalonamide via Car-Parrinello and path integral molecular dynamics.

K. Mierzwicki, Z. Latajka, P. Durlak, 2013, The journal of physical chemistry. B.

Nature of bonding in substituted polyacetylene: A combined AIM–ELF analysis

K. Mierzwicki, Z. Latajka, H. Ratajczak, 2010 .

Density functional studies on the two conformers of 2-fluoro-4,6-dinitrophenol: vibrational assignment based on potential energy distribution

D. Bieńko, Z. Latajka, A. Abkowicz-Bienko, 2000 .

Anharmonic interactions and Fermi resonance in the vibrational spectra of alcohols

Leonid A. Bulavin, Slawomir Berski, Henryk Ratajczak, 2002 .

Quantum delocalization of benzene in the ring puckering coordinates

O. Shishkin, Z. Latajka, Łukasz Walewski, 2014 .

Oxygen bound iodine (O–I): The Electron Localization Function (ELF) study on bonding in cis- and trans-IONO

A. Gordon, Z. Latajka, S. Berski, 2011 .

Quantum chemical topology description of the hydrogen transfer between the ethynyl radical and ammonia (C2H + NH3) – The electron localization function study

Z. Latajka, S. Berski, 2006 .

Crystal structure and bonding properties of Li2I(OH)

K. Mierzwicki, Z. Latajka, Grzegorz Gajewski, 2003 .

Electron localization function (ELF) study on intramolecular delocalization of the electron density in the H2X, H2CX and XO2 (X = O, S, Se, Te) molecules: Role of the atomic core and lone pair

Z. Latajka, S. Berski, Grzegorz Gajewski, 2007 .

Examination of the hydroperoxy radical and its closed-shell analogues the protonation sites: top

Z. Latajka, A. Bil, 2004 .

Entropy versus aromaticity in the conformational dynamics of aromatic rings

J. Leszczynski, O. Shishkin, Z. Latajka, 2013, Journal of Molecular Modeling.

Accuracy of Theoretical Potential Energy Profiles along Proton-Transfer Coordinate for XH−NH3(X = F, Cl, Br) Hydrogen-Bonded Complexes

M. Biczysko, Z. Latajka, 2002 .

Molecular orbital calculations for glycine crystals

Z. Latajka, H. Ratajczak, 1979 .

Matrix Infrared Spectra and ab Initio Calculations of the Nitrous Acid Complexes with Nitrogen Monoxide

Z. Latajka, R. Wieczorek, Z. Mielke, 2000 .

Density functional theory based molecular dynamics simulations of C70O3 doped with light molecules

C. Morrison, Z. Latajka, A. Bil, 2014 .

AIM and ELF analysis of the H-, Me-, and F-substituted FeIII–TAML complexes

K. Mierzwicki, Z. Latajka, S. Berski, 2011 .

Car-Parrinello and Path Integral Molecular Dynamics Study of the Proton Transfer in the Intramolecular Hydrogen Bonds in the Ketohydrazone-Azoenol System.

Z. Latajka, P. Durlak, 2018, The journal of physical chemistry. B.

QUANTUM CHEMICAL STUDY OF THE BIMOLECULAR COMPLEX OF HONO

Z. Latajka, J. Lundell, Robert Wieczorek and, 1999 .

CNDO/2 studies of aminomethylphosphonic and aminomethyl-p-methylphosphinic acids

Z. Latajka, H. Ratajczak, J. Barycki, 1981 .

The hydroperoxy radical as a hydrogen bond acceptor. HOOHCl complexes—Ab initio study

Zdzislaw Latajka, Andrzej Bil, Z. Latajka, 2006, J. Comput. Chem..

CNDO/2 study on lithium bonding in lithium methoxide—Amine systems

Z. Latajka, H. Ratajczak, K. Romanowska, 1978 .

Practical Aspects of Computational Chemistry IV

G. M. Zhidomirov, A. B. Zakharov, M. Shukla, 2016 .