Uniwersytet Wrocławski - Wydział Chemii

Informacje osobiste
Stopień/tytuł
prof. dr hab.
Imię i nazwisko
Zdzisław Latajka
Stanowisko

profesor zwyczajny

Telefon
+48 71 375 7440
Pokój
6 (budynek A)
User profile picture
Kariera naukowa
Mgr 1971, Dr 1978, Dr hab. 1992, Prof. 1999
Lista publikacji
Wersja do druku

Sumaryczny impact factor: 396.997

Liczba publikacji: 176

1. Durlak Piotr, Berski Sławomir, Latajka Zdzisław
Theoretical studies on the molecular structure, conformational preferences, topological and vibrational analysis of allicin.
Chemical Physics Letters, 2016, 644, 5-13
IF: 1.815
10.1016/j.cplett.2015.11.038

2. Mierzwa Grzegorz, Gordon Agnieszka J., Latajka Zdzisław, Berski Sławomir
On the multiple B-O bonding using the topological analysis of electron localisation function (ELF).
Computational and Theoretical Chemistry, 2015, 1053, 130-141
IF: 1.403
10.1016/j.comptc.2014.10.003

3. Durlak Piotr, Latajka Zdzisław
Car-Parrinello and path integral molecular dynamics study of the intramolecular hydrogen bonds in the crystals of benzoylacetone and dideuterobenzoylacetone.
Physical Chemistry Chemical Physics, 2014, 16, 23026-23037
IF: 4.493
10.1039/c4cp02569e

4. Bil Andrzej, Latajka Zdzisław, Morrison Carole A.
Density functional theory based molecular dynamics simulations of C70O3 doped with light molecules.
Chemical Physics, 2014, 428, 121-126
IF: 1.652
10.1016/j.chemphys.2013.10.011

5. Bil Andrzej, Latajka Zdzisław, Hutter Jürg, Morrison Carole A.
Describing the chemical bonding in C70 and C70O3 - a quantum chemical topology study.
Chemical Physics, 2014, 433, 22-30
IF: 1.652
10.1016/j.chemphys.2014.02.003

6. Makarewicz Emilia, Gordon Agnieszka J., Mierzwicki Krzysztof, Latajka Zdzisław, Berski Sławomir
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.
Journal of Physical Chemistry A, 2014, 118, 3980-3989
IF: 2.693
10.1021/jp5022517

7. Berski Sławomir, Gordon Agnieszka J., Latajka Zdzisław
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.
Journal of Physical Chemistry A, 2014, 118, 4147-4156
IF: 2.693
10.1021/jp501838g

8. Sarzyński Dariusz S., Fojcik Łukasz, Gola Agnieszka A., Berkowski Ryszard, Jodkowski Jerzy T., Latajka Zdzisław
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.
Chemical Physics Letters, 2014, 597, 86-93
IF: 1.897
10.1016/j.cplett.2014.02.026

9. Tsuge Masashi, Berski Sławomir, Räsänen Markku, Latajka Zdzisław, Khriachtchev Leonid
Matrix-isolation and computational study of the HXeY…H2O complexes ( Y = Cl, Br, and I).
Journal of Chemical Physics, 2014, 140, 1-10
IF: 2.952
10.1063/1.4862692

10. Walewski Łukasz, Dopieralski Przemysław, Shishkin Oleg V., Latajka Zdzisław
Quantum delocalization of benzene in the ring puckering coordinates.
International Journal of Quantum Chemistry, 2014, 114, 534-542
IF: 1.432
10.1002/qua.24606

11. Cao Qian, Berski Sławomir, Latajka Zdzisław, Räsänen Markku, Khriachtchev Leonid
Reaction of atomic hydrogen with formic acid.
Physical Chemistry Chemical Physics, 2014, 16, 5993-6001
IF: 4.493
10.1039/c3cp55265a

12. Okrasiński Piotr, Latajka Zdzisław, Hättig Christof
Theoretical study on noncovalent interactions in the carbon nanotube-formic acid dimer system.
Journal of Physical Chemistry C, 2014, 118, 4483-4488
IF: 4.772
10.1021/jp411801h

13. Durlak Piotr, Latajka Zdzisław
Ab initio molecular dynamics study of the very short O–H···O hydrogen bonds in the condensed phases.
Journal of Chemical Theory and Computation, 2013, 9, 65-72
IF: 5.31
10.1021/ct300589r

14. Shishkin Oleg V., Dopieralski Przemysław, Omelchenko Irina V., Gorb Leonid, Latajka Zdzisław, Leszczyński Jerzy
Entropy versus aromaticity in the conformational dynamics of aromatic rings.
Journal of Molecular Modeling, 2013, 19, 4073-4077
IF: 4.739
10.1007/s00894-012-1670-2

15. Tsuge Masashi, Berski Sławomir, Räsänen Markku, Latajka Zdzisław, Khriachtchev Leonid
Experimental and computational study of the HXel···HY complexes (Y=Br and I).
Journal of Chemical Physics, 2013, 138, 1-10
IF: 3.122
10.1063/1.4794309

16. Berski Sławomir, Gordon Agnieszka J., Latajka Zdzisław
FONO: a difficult case for theory. The ELF and ELI–D topological studies on the chemical bonding using correlated wavefunctions.
Journal of Chemical Physics, 2013, 138, 1-9
IF: 3.122
10.1063/1.4798637

17. Durlak Piotr, Mierzwicki Krzysztof, Latajka Zdzisław
Investigations of the very short hydrogen bond in the crystal of nitromalonamide via Car–Parrinello and path integral molecular dynamics.
Journal of Physical Chemistry B, 2013, 117, 5430-5440
IF: 3.377
10.1021/jp312473b

18. Cao Qian, Berski Sławomir, Räsänen Markku, Latajka Zdzisław, Khriachtchev Leonid
Spectroscopic and computational characterization of the HCO···H2O complex.
Journal of Physical Chemistry A, 2013, 117, 4385-4393
IF: 2.775
10.1021/jp4009477

19. Shishkina Svitlana V., Slabko Anzhelika I., Berski Sławomir, Latajka Zdzisław, Shishkin Oleg V.
Tuning of character of the N–O bond in HONO from covalent to protocovalent by different types of intramolecular interactions.
Journal of Chemical Physics, 2013, 139, 1-9
IF: 3.122
10.1063/1.4821999

20. Tsuge Masashi, Berski Sławomir, Stachowski Radosław, Räsänen Markku, Latajka Zdzisław, Khriachtchev Leonid
High kinetic stability of HXeBr upon interaction with carbon dioxide: HXeBr···CO2 complex in a xenon matrix and HXeBr in a carbon dioxide matrix.
Journal of Physical Chemistry A, 2012, 116, 4510-4517
IF: 2.771

21. Berski Sławomir, Latajka Zdzisław
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.
International Journal of Quantum Chemistry, 2011, 111, 2378-2389
IF: 1.357

22. Kalinowski Jarosław, Berski Sławomir, Latajka Zdzisław
AIM and BET approach for ionic and covalent bond evolution in reaction of hydrogen elimination from ammonia and lithium hydride.
Chemical Physics Letters, 2011, 501, 587-593
IF: 2.337

23. Mierzwicki Krzysztof, Berski Sławomir, Latajka Zdzisław
AIM and EFL analysis of the H-, Me- and F-substituted FeIII-TAML complexes.
Chemical Physics Letters, 2011, 507, 29-36
IF: 2.337

24. Durlak Piotr, Berski Sławomir, Latajka Zdzisław
Car-Parrinello and path integral molecular dynamics study of the hydrogen bond in the acetic acid dimer in the gas phase.
Journal of Molecular Modeling, 2011, 17, 2995-3004
IF: 1.797

25. Shishkin Oleg V., Dopieralski Przemysław, Omelchenko Irina V., Gorb Leonid, Latajka Zdzisław, Leszczyński Jerzy
Dynamical nonplanarity of benzene. Evidences from the Car-Parrinello molecular dynamics study.
Journal of Physical Chemistry Letters, 2011, 2, 2881-2884
IF: 6.213

26. Berski Sławomir, Latajka Zdzisław, Gordon Agnieszka J.
Electron localization function and electron localizability indicator applied to study the bonding in the peroxynitrous acid HOONO.
Journal of Computational Chemistry, 2011, 32, 1528-1540
IF: 4.583

27. Dopieralski Przemysław D., Burakowski Andrzej, Latajka Zdzisław, Olovsson Ivar
Hydration of NaHCO3, KHCO3, (HCO3-)2, HCO3- and CO32- from molecular dynamics simulation and speed of sound measurements.
Chemical Physics Letters, 2011, 507, 89-95
IF: 2.337

28. Dopieralski Przemysław, Perrin C. L., Latajka Zdzisław
On the intramolecular hydrogen bond in solution: Car-Parrinello and path integral molecular dynamics perspective.
Journal of Chemical Theory and Computation, 2011, 7, 3505-3513
IF: 5.215

29. Berski Sławomir, Latajka Zdzisław, Gordon Agnieszka J.
On the multiple B-N bonding in boron compounds using the topological analysis of electron localization function (ELF).
New Journal of Chemistry, 2011, 35, 89-96
IF: 2.605

30. Berski Sławomir, Latajka Zdzisław, Gordon Agnieszka J.
Oxygen bound iodine (O-I) : the electron localization function (ELF) study on bonding in cis- and trans-IONO.
Chemical Physics Letters, 2011, 506, 15-21
IF: 2.337

31. Durlak Piotr, Latajka Zdzisław
Proton transfer dynamics in the propionic acid dimer from path integral molecular dynamics calculations.
Journal of Molecular Modeling, 2011, 17, 2159-2168
IF: 1.797

32. Panek Paweł, Biczysko Małgorzata S., Latajka Zdzisław
Reinvestigation of spectroscopic properties for ammonia-hydrogen halide complexes from Car-Parrinello molecular dynamics.
Chemical Physics Letters, 2011, 514, 44-48
IF: 2.337

33. Berski Sławomir, Latajka Zdzisław, Gordon Agnieszka J.
Ab initio and quantum chemical topology studies on the isomerization of HONO to HNO2. Effect of the basis set in QCT.
Journal of Computational Chemistry, 2010, 31, 2555-2567
IF: 4.05

34. Durlak Piotr, Latajka Zdzisław
Car-Parrinello and path integral molecular dynamics study of the hydrogen bonds in 2-acetyl-1,8-dihydroxy-3,6-dimethylnaphthalene.
Chemical Physics Letters, 2010, 499, 56-61
IF: 2.282

35. Durlak Piotr, Mierzwicki Krzysztof, Latajka Zdzisław, Ratajczak Henryk
Nature of bonding in substituted polyacetylene: a combined AIM-ELF analysis.
Journal of Molecular Structure, 2010, 976, 392-396
IF: 1.599

36. Berski Sławomir, Latajka Zdzisław, Gordon Agnieszka J.
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.
Chemical Physics Letters, 2010, 493, 392-398
IF: 2.282

37. Dopieralski Przemysław D., Latajka Zdzisław, Olovsson Ivar
Proton transfer dynamics in crystalline maleic acid from molecular dynamics calculations.
Journal of Chemical Theory and Computation, 2010, 6, 1455-1461
IF: 5.138

38. Dopieralski Przemysław D., Latajka Zdzisław, Olovsson Ivar
Proton-transfer dynamics in the (HCO3-)2 dimer of KHCO3 from Car-Parrinello and path-integrals molecular dynamics calculations.
Acta Crystallographica Section B: Structural Science Crystal Engineering and Materials, 2010, B66, 222-228
IF: 1.829

39. Berski Sławomir, Latajka Zdzisław, Gordon Agnieszka J.
Quantum chemical topology study on the electronic structure of cis- and trans-FONO.
Journal of Chemical Physics, 2010, 133, 1-9
IF: 2.921

40. Berski Sławomir, Latajka Zdzisław
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.
International Journal of Quantum Chemistry, 2010, 110, 1890-1900
IF: 1.302

41. Shishkin Oleg V., Dopieralski Przemysław, Palamarchuk G. V., Latajka Zdzisław
Rotation around the glycosidic bond as driving force of proton transer in protonated 2'-deoxyriboadenosine monophosphate (dAMP).
Chemical Physics Letters, 2010, 490, 221-225
IF: 2.282

42. Durlak Piotr, Latajka Zdzisław, Berski Sławomir
A Car-Parrinello and path integral molecular dynamics study of the intramolecular lithium bond in the lithium 2-pyridyl-N-oxide acetate.
Journal of Chemical Physics, 2009, 131, 1-8
IF: 3.093

43. Bil Andrzej, Latajka Zdzisław, Morrison Carole A.
C70 oxides and ozonides and the mechanism of ozonolysis on the fullerene surface. A theoretical study.
Journal of Physical Chemistry A, 2009, 113, 9891-9898
IF: 2.899

44. Durlak Piotr, Latajka Zdzisław
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.
Chemical Physics Letters, 2009, 480, 173-177
IF: 2.291

45. Durlak Piotr, Latajka Zdzisław
Car-Parrinello molecular dynamics and density functional theory simulations of infrared spectra for acetic acid monomers and cyclic dimers.
Chemical Physics Letters, 2009, 477, 249-254
IF: 2.291

46. Wieczorek Robert, Durlak Piotr, Latajka Zdzisław
DFT studies of H3N–X (X= Li, Na, K, Rb, Cs and Fr) systems.
Polish Journal of Chemistry, 2009, 83, 761-769
IF: 0.523

47. Yaremko Anatoly M., Ratajczak Henryk, Barnes Austin J., Baran Jan, Durlak Piotr, Latajka Zdzisław
Fermi resonance and strong anharmonic effects in the absorption spectra of the ν-OH (ν-OD) vibration of solid H–and D-benzoic acid.
Chemical Physics, 2009, 364, 51-63
IF: 2.277

48. Dopieralski Przemysław, Panek Jarosław, Latajka Zdzisław
First-principles investigation of isomerization by proton transfer in β-fumaric acid crystal.
Journal of Chemical Physics, 2009, 130, 1-9
IF: 3.093

49. Latajka Zdzisław, Gajewski Grzegorz, Barnes Austin J., Xue D., Ratajczak Henryk
Hyperpolarizabilities of some model hydrogen-bonded complexes: PM3 andab initio studies.
Journal of Molecular Structure, 2009, 928, 121-124
IF: 1.551

50. Dopieralski Przemysław D., Latajka Zdzisław, Olovsson Ivar
Proton distribution in KHCO3 from ab initio molecular dynamics simulation.
Chemical Physics Letters, 2009, 476, 223-226
IF: 2.291

51. Dopieralski Przemysław, Panek Jarosław, Mierzwicki Krzysztof, Latajka Zdzisław, Ratajczak Henryk, Barnes Austin J.
Theoretical study on the polarizability and hyperpolarizability of hydrogen bonded complexes of nitropyridines with hydrogen fluoride.
Journal of Molecular Structure-Theochem, 2009, 916, 72-75
IF: 1.216

52. Ratajczak Henryk, Barnes Austin J., Baran Jan, Yaremko Anatoly M., Latajka Zdzisław, Dopieralski Przemysław
Anharmonic interactions and infrared bandshape of the hydrogen bond vibration of potassium hydrogen (deuterium) maleate crystals.
Journal of Molecular Structure, 2008, 887, 9-19
IF: 1.594

53. Latajka Zdzisław, Gajewski Grzegorz, Barnes Austin J., Ratajczak Henryk
Hyperpolarizabilities of hydrogen-bonded complexes of phenol derivatives with ammonia: PM3 andab initio studies.
Journal of Molecular Structure, 2008, 880, 48-51
IF: 1.594

54. Berski Sławomir, Mierzwicki Krzysztof, Bil Andrzej, Latajka Zdzisław
The protocovalent N—O bond: quantum chemical topology (QCT of ELF and ELI-D) study on the bonding in the nitrous acid H—O—N=O and its relevancy to the experiment.
Chemical Physics Letters, 2008, 460, 559-562
IF: 2.169

55. Kisowska Karolina, Berski Sławomir, Latajka Zdzisław
The structure and chemical bonding in the N2—CuX and N2···XCu ( X= F, Cl, Br) systems studied by means of the molecular orbital and quantum chemical topology methods.
Journal of Computational Chemistry, 2008, 29, 2677-2692
IF: 3.39

56. Lundell Jan, Latajka Zdzisław
Vibrational calculations for the H2O...CO complex.
Journal of Molecular Structure, 2008, 887, 172-179
IF: 1.594

57. Durlak Piotr, Morrison Carole A., Middlemiss D. S., Latajka Zdzisław
Car-Parrinello and path integral molecular dynamics study of the hydrogen bond in the chloroacetic acid dimer system.
Journal of Chemical Physics, 2007, 127, 1-8
IF: 3.044

58. Berski Sławomir, Gajewski Grzegorz, Latajka Zdzisław
Electron localization function (ELF) study on intramolecular delocalization of the electron density in the H2X, H2C=X and XO2 ( X= O, S, Se, Te) molecules: role of the atomic core and lone pair.
Journal of Molecular Structure, 2007, 844-845, 278-285
IF: 1.486

59. Latajka Zdzisław, Gajewski Grzegorz, Barnes Austin J., Ratajczak Henryk
Hyperpolarizabilities of strongly hydrogen-bonded molecular complexes: PM3 andab initio studies.
Journal of Molecular Structure, 2007, 844-845, 340-342
IF: 1.486

60. Bil Andrzej, Berski Sławomir, Latajka Zdzisław
On three-electron bonds and hydrogen bonds in the open-shell complexes. [H2X2]+ for X= F, Cl and Br.
Journal of Chemical Information and Modeling, 2007, 47, 1021-1030
IF: 2.986

61. Panek Jarosław J., Wawrzyniak P. K., Latajka Zdzisław, Lundell Jan
Interaction energy decomposition analysis for formic acid complexes with argon and krypton atoms.
Chemical Physics Letters, 2006, 417, 100-104
IF: 2.462

62. Lundell Jan, Berski Sławomir, Lignell A., Latajka Zdzisław
Quantum chemical study of the hydrogen-bonded HXeOH-H2O complex.
Journal of Molecular Structure, 2006, 790, 31-39
IF: 1.495

63. Berski Sławomir, Latajka Zdzisław
Quantum chemical topology description of the hydrogen transfer between the ethynyl radical and ammonia (C2H. + NH3) - the electron localization function study.
Chemical Physics Letters, 2006, 426, 273-279
IF: 2.462

64. Bil Andrzej, Latajka Zdzisław
The hydroperoxy radical as a hydrogen bond acceptor. HOO–HCl complexes—ab initio study.
Journal of Computational Chemistry, 2006, 27, 287-295
IF: 4.893

65. Bil Andrzej, Latajka Zdzisław
Hydroperoxy radical as hydrogen bond donor : NH3-HOO complex - ab initio and topological study.
Chemical Physics Letters, 2005, 406, 366-370
IF: 2.438

66. Panek Jarosław, Jezierska Aneta, Mierzwicki Krzysztof, Latajka Zdzisław, Koll Aleksander
Molecular modeling study of leflunomide and its active metabolite analogues.
Journal of Chemical Information and Modeling, 2005, 45, 39-48
IF: 2.923

67. Wawrzyniak P. K., Panek Jarosław, Lundell Jan, Latajka Zdzisław
On the nature of bonding in HCOOH...Ar and HCOOH...Kr complexes.
Journal of Molecular Modeling, 2005, 11, 351-361
IF: 1.67

68. Asselin P., Goubet M., Latajka Zdzisław, Soulard P., Lewerenz M.
Vibrational dynamics of the hydrogen bonded complexes (CH2)2O–HF and –DF investigated by combined jet- and cell-Fourier transform infrared spectroscopy.
Physical Chemistry Chemical Physics, 2005, 7, 592-599
IF: 2.519

69. Atamas N.A., Yaremko Anatoly M., Seeger T., Leipertz A., Bieńko Agnieszka, Latajka Zdzisław, Ratajczak Henryk, Barnes Austin J.
A study of the Raman spectra of alkanes in the Fermi-resonance region.
Journal of Molecular Structure, 2004, 708, 189-195
IF: 1.2

70. Stępień Marcin, Latos-Grażyński Lechosław, Szterenberg Ludmiła, Panek Jarosław, Latajka Zdzisław
Cadmium(II) and nickel(II) complexes of benziporphyrins. A study of weak intramolecular metal-arene interactions.
Journal of the American Chemical Society, 2004, 126, 4566-4580
IF: 6.903

71. Berski Sławomir, Ciunik Zbigniew, Drabent Krzysztof, Latajka Zdzisław, Panek Jarosław
Dominant role of C-Br···N halogen bond in molecular self-organization. Crystallographic and quantum-chemical study of Schiff-base-containing triazoles.
Journal of Physical Chemistry B, 2004, 108, 12327-12332
IF: 3.834

72. Bil Andrzej, Latajka Zdzisław
Examination of the hydroperoxy radical and its closed-shell "analogues" - the protonation sites: topological predictions and ab initio study of the protonated forms.
Chemical Physics, 2004, 305, 243-252
IF: 2.316

73. Gawryszewska Paula, Malta Oscar L., Longo Ricardo L., Silva F. R. G. e, Alves S., Mierzwicki Krzysztof, Latajka Zdzisław, Pietraszkiewicz M., Legendziewicz Janina
Experimental and theoretical study of the photophysics and structures of europium cryptates incorporating 3,3'-bi-isoquinoline-2,2'-dioxide.
ChemPhysChem, 2004, 5, 1577-1584
IF: 3.596

74. Krajewska Magdalena, Latajka Zdzisław, Mielke Zofia, Mierzwicki Krzysztof, Olbert-Majkut Adriana, Sałdyka Magdalena
Hydrogin bonding in allene complexes with nitric and nitrous acids: theoretical and infrared matrix isolation study.
Journal of Physical Chemistry B, 2004, 108, 15578-15586
IF: 3.834

75. Bil Andrzej, Latajka Zdzisław
The examination of the hydroperoxy radical and its closed-shell "analogues" by means of topological methods of quantum chemistry: AIM and ELF.
Chemical Physics, 2004, 303, 43-53
IF: 2.316

76. Bil Andrzej, Latajka Zdzisław
The hydroperoxy radical and its closed-shell,analoques,: ab initio investigations.
Chemical Physics Letters, 2004, 388, 158-163
IF: 2.438

77. Wawrzyniak P. K., Panek Jarosław, Latajka Zdzisław, Lundell Jan
Theoretical study of the complex between formic acid and argon.
Journal of Molecular Structure, 2004, 704, 297-304
IF: 1.2

78. Goubet M., Asselin P., Soulard P., Lewerenz M., Latajka Zdzisław
Vibrational dynamics of medium strength hydrogen bonds: Fourier transform infrared spectra and band contour analysis of the DF stretching region of (CH2)2 S–DF.
Journal of Chemical Physics, 2004, 121, 7784-7794
IF: 3.105

79. Lundell Jan, Berski Sławomir, Latajka Zdzisław
Ab initio characterization of the xenon dihydride dimer - (HXeH)2.
Chemical Physics Letters, 2003, 371, 295-303
IF: 2.438

80. Mierzwicki Krzysztof, Latajka Zdzisław
Basis set superposition error in N-body clusters.
Chemical Physics Letters, 2003, 380, 654-664
IF: 2.438

81. Gajewski Grzegorz, Mierzwicki Krzysztof, Latajka Zdzisław
Crystal structure and bonding properties of Li2I(OH).
Chemical Physics Letters, 2003, 369, 139-144
IF: 2.438

82. Latajka Zdzisław, Gajewski Grzegorz, Ratajczak Henryk, Venturini J.
Hyperpolarizalities of pyridine derivatives and their protonated species:ab initio studies.
Bulletin of the Polish Academy of Sciences. Chemistry, 2003, 51, 1-4
IF: 0.271

83. Bieńko Agnieszka, Latajka Zdzisław, Sawka-Dobrowolska Wanda, Sobczyk Lucjan, Ozeryanskii Valery A., Pozharskii Alexander F., Grech Eugeniusz, Nowicka-Scheibe J.
Low barrier hydrogen bond in protonated proton sponge. X-ray diffraction, infrared, and theoretical ab initio and density functional theory studies.
Journal of Chemical Physics, 2003, 119, 4313-4319
IF: 2.95

84. D'Amelio N., Gaggelli Elena, Gajewska A., Kochman H., Kochman K., Kozłowski Henryk, Latajka Zdzisław, Młynarz Piotr, Panek Jarosław, Valensin Gianni
Structural analysis and sheep pituitary receptor binding of GnRH and its complexes with metal ions.
Journal of Inorganic Biochemistry, 2003, 94, 28-35
IF: 2.343

85. Utko Józef, Przybylak Szymon, Jerzykiewicz Lucjan B., Mierzwicki Krzysztof, Latajka Zdzisław, Sobota Piotr
The first structurally characterized nonorganometallic titanium(III) alkoxo-bridged dinuclear complexes.
Inorganic Chemistry, 2003, 42, 267-269
IF: 3.389

86. Bieńko Agnieszka, Latajka Zdzisław
Theoretical study on the structures and vibrational spectra of the H2SO4—(CO2)x (x=1, 2) hydrogen bonded complexes.
Chemical Physics Letters, 2003, 374, 577-582
IF: 2.438

87. Biczysko Małgorzata S., Latajka Zdzisław
Accuracy of theoretical potential energy profiles along proton-transfer coordinate for XH-NH3 (X=F, Cl, Br) hydrogen-bonded complexes.
Journal of Physical Chemistry A, 2002, 106, 3197-3201
IF: 2.765

88. Atamas N.A., Yaremko Anatoly M., Bulavin L. A., Pogorelov V. E., Berski Sławomir, Latajka Zdzisław, Ratajczak Henryk, Abkowicz-Bieńko Agnieszka J.
Anharmonic interactions and Fermi resonance in the vibrational spectra of alcohols.
Journal of Molecular Structure, 2002, 605, 187-198
IF: 1.122

89. Berski Sławomir, Latajka Zdzisław
Comparison of lithium and hydrogen bonds in (X···Li···X)- and (X···H···X)- (X=F, Cl and Br) complexes: topological analysis of electron localization function.
International Journal of Quantum Chemistry, 2002, 90, 1108-1120
IF: 1.514

90. Bieńko Agnieszka, Latajka Zdzisław
Density functional studies of 1:1 and 1:2 sulfuric acid complexes with carbon monoxide.
Chemical Physics, 2002, 282, 207-218
IF: 2.203

91. Gajewski Grzegorz, Latajka Zdzisław, Ratajczak Henryk
Density functional studies of the cobaltous acid dimer-preliminary results.
Bulletin of the Polish Academy of Sciences. Chemistry, 2002, 50, 131-137
IF: 0.159

92. Panek Jarosław, Latajka Zdzisław, Lundell Jan
DFT calculations of HRgX (Rg = rare gas; X = halogen) molecules.
Physical Chemistry Chemical Physics, 2002, 4, 2504-2510
IF: 1.838

93. Olbert-Majkut Adriana, Mielke Zofia, Wieczorek Robert, Latajka Zdzisław
Matrix isolation and DFT studies of nitrous acid complexes with nitrogen dioxide.
International Journal of Quantum Chemistry, 2002, 90, 1140-1150
IF: 1.514

94. Barnes Austin J., Latajka Zdzisław, Biczysko Małgorzata S.
Proton transfer in strongly hydrogen-bonded molecular complexes: matrix effects.
Journal of Molecular Structure, 2002, 614, 11-21
IF: 1.122

95. Berski Sławomir, Latajka Zdzisław, Andrés Juan
The nature of the Au-Rg bond in the [AuRg4]2+ (Rg=Ar, Kr and Xe) molecules.
Chemical Physics Letters, 2002, 356, 483-489
IF: 2.526

96. Lundell Jan, Latajka Zdzisław
Density functional studies of hydrogen-bonded systems. II. Solvation of the H2O-CO complex by a nonpolar solvent.
Chemical Physics, 2001, 263, 221-230
IF: 1.957

97. Berski Sławomir, Latajka Zdzisław, Silvi Bernard, Lundell Jan
Electron localization function studies of the nature of binding in neutral rare-gas containing hydrides: HKrCN, HKrNC, HXeCN, HXeNC, HXeOH, and HXeSH.
Journal of Chemical Physics, 2001, 114, 4349-4358
IF: 3.147

98. Mierzwicki Krzysztof, Latajka Zdzisław
Nonadditivity of interaction in Li(NH3)</sub>
Chemical Physics, 2001, 265, 301-311
IF: 1.957

99. Lundell Jan, Panek Jarosław, Latajka Zdzisław
Quantum chemical calculations on FXeSiF.
Chemical Physics Letters, 2001, 348, 147-154
IF: 2.364

100. Latajka Zdzisław, Ratajczak Henryk
Quantum chemical studies Cl-...HNO complex in the singlet and triplet electronic states.
Bulletin of the Polish Academy of Sciences. Chemistry, 2001, 49, 125-131
IF: 0.342

101. Ratajczak Henryk, Baran Jan, Barnes Austin J., Barycki J., Debrus S., Latajka Zdzisław, May M., Pietraszko Adam
Structural and vibrational study of a novel nonlinear optical material: 3-nitrobenzoic acid hydrazide.
Journal of Molecular Structure, 2001, 596, 17-23
IF: 0.907

102. Gumienna-Kontecka Elżbieta, Berthon G., Fritsky Igor O., Wieczorek Robert, Latajka Zdzisław, Kozłowski Henryk
2-(Hydroxyimino)propanohydroxamic acid, a new effective ligand for aluminium.
Journal of the Chemical Society, Dalton Transactions, 2000, 4201-4208
IF: 2.502

103. Berski Sławomir, Lundell Jan, Latajka Zdzisław
A density functional study of the xenon dihydride-water complex.
Journal of Molecular Structure, 2000, 552, 223-232
IF: 0.849

104. Panek Jarosław, Latajka Zdzisław
A theoretical study of NO2 complexes with aluminium and gallium based on topological analysis of electron density and electron localization function.
Chemical Physics Letters, 2000, 332, 617-623
IF: 2.364

105. Mierzwicki Krzysztof, Latajka Zdzisław
Basis set superposition error in calculations of nonadditive effects in Li(NH3)</sub>
Chemical Physics Letters, 2000, 325, 465-472
IF: 2.364

106. Abkowicz-Bieńko Agnieszka J., Bieńko D. C., Latajka Zdzisław
Density functional studies on the two conformers of 2-fluoro-4,6-dinitrophenol: vibrational assignment based on potential energy distribution.
Journal of Molecular Structure, 2000, 552, 165-175
IF: 0.849

107. Abkowicz-Bieńko Agnieszka J., Latajka Zdzisław
Density functional study on phenol derivative-ammonia complexes in the gas phase.
Journal of Physical Chemistry A, 2000, 104, 1004-1008
IF: 2.754

108. Kozłowski Mirosław, Kołodziej Hubert A., Wieczorek Robert, Latajka Zdzisław, Jurlewicz A.
Dielectric relaxation and molecular conformational energy of some arylazo benzothiazine derivatives.
Chemical Physics, 2000, 252, 289-299
IF: 1.908

109. Lundell Jan, Berski Sławomir, Latajka Zdzisław
Dihydrogen-bonded complexes of xenon dihydride with water: Ab initio calculations and topological analysis of electron localisation function (ELF).
Physical Chemistry Chemical Physics, 2000, 2, 5521-5527
IF: 1.653

110. Młynarz Piotr, Gaggelli Nicola, Panek Jarosław, Stasiak M., Valensin Gianni, Kowalik-Jankowska Teresa, Leplawy M. T., Latajka Zdzisław, Kozłowski Henryk
How the α-hydroxymethylserine residue stabilizes oligopeptide complexes with nickel(II) and copper(II) ions.
Journal of the Chemical Society, Dalton Transactions, 2000, 1033-1038
IF: 2.502

111. Mielke Zofia, Latajka Zdzisław, Olbert-Majkut Adriana, Wieczorek Robert
Matrix infrared spectra and ab initio calculations of the nitrous acid complexes with nitrogen monoxide.
Journal of Physical Chemistry A, 2000, 104, 3764-3769
IF: 2.754

112. Mierzwicki Krzysztof, Berski Sławomir, Latajka Zdzisław
Nature of chemical bonds in MCCH(M=Li, Na, K) based on the topological analysis of electron localisation function (ELF) and electron density.
Chemical Physics Letters, 2000, 331, 538-546
IF: 2.364

113. Abkowicz-Bieńko Agnieszka J., Biczysko Małgorzata S., Latajka Zdzisław
Solvent effect on hydrogen bonded ammonia-hydrogen halide complexes: continuum medium versus cluster models.
Computers and Chemistry, 2000, 24, 303-309
IF: 0.926

114. Fuster F., Silvi Bernard, Berski Sławomir, Latajka Zdzisław
Topological aspects of protonation and hydrogen bonding: the dihydrogen bond case.
Journal of Molecular Structure, 2000, 555, 75-84
IF: 0.849

115. Latajka Zdzisław, Mielke Zofia, Olbert-Majkut Adriana, Wieczorek Robert, Tokhadze K. G.
Ab initio calculations and matrix infrared spectra ot the nitrous acid complexes with HF and HCl.
Physical Chemistry Chemical Physics, 1999, 1, 2441-2448
IF: 1.848

116. Berski Sławomir, Silvi Bernard, Latajka Zdzisław, Leszczyński Jerzy
Bonding in hypohalous acids HOX (X = F, Cl, Br, and I) from the topological analysis of the electron localization function (ELF).
Journal of Chemical Physics, 1999, 111, 1-14
IF: 3.289

117. Stepanian S. G., Reva I. D., Radchenko E. D., Latajka Zdzisław, Wierzejewska Maria, Ratajczak Henryk
Combined matrix isolation IR spectroscopic and ab initio quantum chemical study of the molecular structure of aminomethylphosphinic acid.
Journal of Molecular Structure, 1999, 484, 19-30
IF: 0.868

118. Silvi Bernard, Wieczorek Robert, Latajka Zdzisław, Alikhani M. E., Dkhissi A., Bouteiller Y.
Critical analysis of the calculated frequency shifts of hydrogen-bonded complexes. .
Journal of Chemical Physics, 1999, 111, 6671-6678
IF: 3.289

119. Lundell Jan, Berski Sławomir, Latajka Zdzisław
Density functional study of the Xe2H3+ cation.
Chemical Physics, 1999, 247, 215-224
IF: 1.766

120. Wieczorek Robert, Latajka Zdzisław, Lundell Jan
Quantum chemical study of the bimolecular complex of HONO.
Journal of Physical Chemistry A, 1999, 103, 6234-6239
IF: 2.695

121. Biczysko Małgorzata S., Latajka Zdzisław
The influence of water molecules on the proton position in H3N-HX (X = F, Cl, Br) complexes.
Chemical Physics Letters, 1999, 313, 366-373
IF: 2.269

122. Abkowicz-Bieńko Agnieszka J., Latajka Zdzisław, Bieńko D. C., Michalska D.
Theoretical infrared spectrum and revised assignment for para-nitrophenol. Density functional theory studies.
Chemical Physics, 1999, 250, 123-129
IF: 1.766

123. Panek Jarosław, Latajka Zdzisław
Theoretical study of aluminum and gallium atom complexes with CO2, CS2 and COS.
Journal of Physical Chemistry A, 1999, 103, 6845-6850
IF: 2.695

124. Bouteiller Y., Desfranois C., Schermann J. P., Latajka Zdzisław, Silvi Bernard
Calculation of electronic affinity and vertical detachment energy of the water dimer complex using the density functional theory.
Journal of Chemical Physics, 1998, 108, 7967-7972
IF: 3.147

125. Wierzejewska Maria, Mielke Zofia, Wieczorek Robert, Latajka Zdzisław
Infrared matrix isolation and theoretical studies of SO2-HNO3 and SO2-HONO systems.
Chemical Physics, 1998, 228, 17-29
IF: 1.707

126. Ciunik Zbigniew, Berski Sławomir, Latajka Zdzisław, Leszczyński Jerzy
New aspects of weak C-Hp bonds: intermolecular interactions between alicyclic and aromatic rings in crystals of small compounds, peptides and proteins.
Journal of Molecular Structure, 1998, 442, 125-134
IF: 0.807

127. Berski Sławomir, Latajka Zdzisław
On the difference between hydrogen fluoride and hydrogen chloride crystals.
Journal of Molecular Structure, 1998, 450, 259-263
IF: 0.807

128. Berski Sławomir, Lundell Jan, Latajka Zdzisław, Leszczyński Jerzy
Oxygen-bound fluorine (O-F): Ab Initio investigations of the hypofluorous acid dimer.
Journal of Physical Chemistry A, 1998, 102, 10768-10776
IF: 1.95

129. Berski Sławomir, Latajka Zdzisław
Periodic Hartree-Fock studies on (HCl)∞ chain.
Polish Journal of Chemistry, 1998, 72, 1540-1550
IF: 0.508

130. Lundell Jan, Latajka Zdzisław
Density functional study of hydrogen-bonded systems: the water-carbon monoxide complex.
Journal of Physical Chemistry A, 1997, 101, 5004-5009
IF: 3.392

131. Mróz Iwona, Latajka Zdzisław
Direction of protein biosynthesis as a reflection of the prebiotic environment.
Journal of Theoretical Biology, 1997, 189, 151-158
IF: 1.409

132. Mosyagin N. S., Titov A. V., Latajka Zdzisław
Generalized relativistic effective core potential: Gaussian expansions of potentials and pseudospinors for atoms Hg through Rn.
International Journal of Quantum Chemistry, 1997, 63, 1107-1122
IF: 1.341

133. Berski Sławomir, Latajka Zdzisław
On the role of the basis set and electron correlation in the description of stacking interactions.
Computers and Chemistry, 1997, 21, 347-354
IF: 1.064

134. Berski Sławomir, Latajka Zdzisław
Periodic Hartree-Fock study of (HF)∞ chain.
Journal of Molecular Structure-Theochem, 1997, 389, 147-154
IF: 0.884

135. Boldeskul I. E., Tsymbal I. F., Ryltsev E. V., Latajka Zdzisław, Barnes Austin J.
Reversion of the usual ν(C-H/D) spectral shift of haloforms in some hydrogen-bonded complexes.
Journal of Molecular Structure, 1997, 436-437, 167-171
IF: 0.884

136. Latajka Zdzisław, Scheiner S.
Structure, energetics and vibrational spectra of dimers, trimers and tetramers of HX (X = Cl, Br, I).
Chemical Physics, 1997, 216, 37-52
IF: 1.99

137. Latajka Zdzisław, Berski Sławomir
Density functional study of the H3N-Cl2 system - the importance of Hartree-Fock exchange in density functional methods.
Journal of Molecular Structure-Theochem, 1996, 371, 11-16
IF: 0.921

138. Michalska D., Bieńko D. C., Abkowicz-Bieńko Agnieszka J., Latajka Zdzisław
Density functional, Hartree-Fock and MP2 studies on the vibrational spectrum of phenol.
Journal of Physical Chemistry, 1996, 100, 17786-17790
IF: 3.366

139. Latajka Zdzisław, Scheiner S., Bouteiller Y., Ratajczak Henryk
Influence of electron correlation effects on calculated properties and vibrational spectra of FF··· NH3 and FCl··· NH3 charge transfer complexes.
Journal of Molecular Structure, 1996, 376, 343-351
IF: 0.867

140. Mielke Zofia, Latajka Zdzisław, Kołodziej J., Tokhadze K. G.
Matrix infrared spectra and ab initio calculations of the nitrous acid complexes with N2 and CO.
Journal of Physical Chemistry, 1996, 100, 11610-11615
IF: 3.366

141. Mielke Zofia, Tokhadze K. G., Latajka Zdzisław, Ratajczak E.
Spectroscopic and theoretical studies of the complexs between nitrous acid and ammonia.
Journal of Physical Chemistry, 1996, 100, 539-545
IF: 3.366

142. Tokhadze K. G., Uspensky A. I., Mielke Zofia, Latajka Zdzisław, Ratajczak Henryk
Spectroscopic and theoretical studies of the OCO··· HF complex in pressurized gases.
Journal of the Chemical Society, Faraday Transactions, 1996, 92, 3473-3479
IF: 1.663

143. Latajka Zdzisław, Bouteiller Y., Scheiner S.
Critical assessment of density functional methods for study of proton transfer processes (FHF)-.
Chemical Physics Letters, 1995, 234, 159-64
IF: 2.509

144. Ostrovskii D. I., Valakh M. Ya., Karaseva T. A., Latajka Zdzisław, Ratajczak Henryk, Yaremko Anatoly M.
High-frequency vibrational spectra of hydrated antimony pentoxide.
Optics and Spectroscopy, 1995, 78, 378-386
IF: 0.377

145. Latajka Zdzisław, Ratajczak Henryk
Molecular structure of betaine ab initio study.
Bulletin of the Polish Academy of Sciences. Chemistry, 1995, 43, 103-107
IF: 0.198

146. Ventura O. N., Latajka Zdzisław, Ratajczak Henryk, Orville-Thomas W. J.
On the structure of the 3B1 excited state of water.
Journal of Molecular Structure, 1995, 334, 127-136
IF: 0.948

147. Abkowicz-Bieńko Agnieszka J., Latajka Zdzisław, Scheiner S., Chalasinski G.
Site-site function and successive reaction counterpoise calculation of basis setsuperposition error for proton transfer.
Journal of Molecular Structure, 1995, 342, 153-159
IF: 0.948

148. Latajka Zdzisław, Ratajczak Henryk, Wasif S., Salama S. B.
Structure and energetics of SO2-X- (X = F, Cl, Br and I) complexes.
Journal of Molecular Structure-Theochem, 1995, 333, 291-296
IF: 0.986

149. Dolenko G. N., Latajka Zdzisław, Ratajczak Henryk
X-ray spectral determination of the effective charges on phosphorus, sulfur, and chlorine atoms in chemical comopunds with a nonempirical charge scale.
Heteroatom Chemistry, 1995, 6, 553-557
IF: 0.608

150. Latajka Zdzisław, Bouteiller Y.
Application of density functional methods for the study of hydrogen-bonded systems: the hydrogen fluoride dimer.
Journal of Chemical Physics, 1994, 101, 9793-9799
IF: 3.635

151. Pagsberg P., Ratajczak E., Sillesen A., Latajka Zdzisław
Kinetics and thermochemistry of the reversible gas phase reaction HONO + NH3H3N - HONO studied by infrared diode laser spectroscopy.
Chemical Physics Letters, 1994, 227, 6-12
IF: 2.614

152. Lundell Jan, Räsänen Markku, Latajka Zdzisław
Matrix isolation FTIR and ab initio study of complexes between formic acid and nitrogen.
Chemical Physics, 1994, 189, 245-260
IF: 1.867

153. Bouteiller Y., Latajka Zdzisław
New theoretical interpretation of acetone - FX (X =H, D) infrared spectrum in the gas phase.
Journal of Molecular Structure, 1994, 322, 175-180
IF: 0.837

154. Latajka Zdzisław, Ratajczak Henryk
On the role of bond functions in accurate description of hydrogen-bonded systems hydrogen fluoride dimer.
Bulletin of the Polish Academy of Sciences. Chemistry, 1994, 42, 571-576
IF: 0.116

155. Ventura O. N., Irving K., Latajka Zdzisław
The dimerization shift of the OH-stretching fundamentals of the water dimer.
Chemical Physics Letters, 1994, 217, 436-442
IF: 2.614

156. Lundell Jan, Räsänen Markku, Latajka Zdzisław
Theoretical study of the H2O-2CO hydrogen-bonded ternary complexes.
Chemical Physics Letters, 1994, 222, 33-39
IF: 2.614

157. Lundell Jan, Räsänen Markku, Latajka Zdzisław
Complexes between formic acid and carbon monoxide : an ab initio investigation.
Journal of Physical Chemistry, 1993, 97, 1152-1157
IF: 3.395

158. Mijoule C., Latajka Zdzisław, Borgis D.
Density functional theory applied to proton-transfer systems : a numerical test.
Chemical Physics Letters, 1993, 208, 364-368
IF: 3.018

159. Silvi Bernard, Latajka Zdzisław, Ratajczak Henryk
Pseudopotential periodic hartree-fock investigation of potassium dihydrogen phosphate.
Ferroelectrics, 1993, 150, 303-311

160. Bouteiller Y., Sadi S., Latajka Zdzisław, Ratajczak Henryk
Ab initio study proton transfer between methylnitroamine and trimethylamine.
Chemical Physics Letters, 1992, 199, 55-61
IF: 2.686

161. Latajka Zdzisław, Schenker S., Chalasinski G.
Basis set superposition error in proton transfer potentials.
Chemical Physics Letters, 1992, 196, 384-389
IF: 2.686

162. Latajka Zdzisław, Scheiner S.
Proton transfer in the ground and first excited triplet states of malonaidehyde.
Journal of Physical Chemistry, 1992, 96, 9764-9767
IF: 3.452

163. Latajka Zdzisław
Structure, energetics, and vibrational spectrum of H2O-X- (X = F, Cl) complexes.
Journal of Molecular Structure-Theochem, 1992, 253, 225-241
IF: 0.951

164. Latajka Zdzisław, Scheiner S., Ratajczak Henryk
The proton position in amine - HX (X= Br, I) complexes.
Chemical Physics, 1992, 166, 85-96
IF: 1.963

165. Bouteiller Y., Latajka Zdzisław
Theoretical interpreation of acetone-HF infrared spectrum in the gas phase.
Journal of Chemical Physics, 1992, 97, 145-149
IF: 3.433

166. Bouteiller Y., Latajka Zdzisław, Ratajczak Henryk, Scheiner S.
Theoretical vibrational study of FX…NH3 ( X = H, D, Li) complexes.
Journal of Chemical Physics, 1991, 94, 2956-2960
IF: 3.568

167. Moc Jerzy, Rudziński J. M., Latajka Zdzisław, Ratajczak Henryk
Ab initio calculation of the inversion barrier in the trichloromethyl radical.
Chemical Physics Letters, 1990, 168, 79-83
IF: 2.404

168. Alagona G., Ghio C., Latajka Zdzisław, Tomasi J.
Basis set superposition errors and counterpoise corrections for some basis sets evaluated for a few X-···M dimers.
Journal of Physical Chemistry, 1990, 94, 2267-2273
IF: 3.144

169. Latajka Zdzisław
Basis sets for molecular interactions. Part 3. Properties of isolated subunits.
Journal of Molecular Structure-Theochem, 1990, 205, 13-24
IF: 0.942

170. Latajka Zdzisław, Scheiner S.
Correlation between interaction energy and shift of the carbonyl stretching frequency.
Chemical Physics Letters, 1990, 174, 179-184
IF: 2.404

171. Latajka Zdzisław, Scheiner S.
Structure, energetics and vibrational spectrum of H3N··HOH.
Journal of Physical Chemistry, 1990, 94, 217-221
IF: 3.144

172. Latajka Zdzisław, Ratajczak Henryk, Murto J., Orville-Thomas W. J.
Ab initio study of interactions between methanol and nitrogen or carbon monoxide.
Journal of Molecular Structure, 1989, 194, 45-60
IF: 0.858

173. Latajka Zdzisław, Scheiner S.
Dissection of basis set superposition error at SCF and correlated levels : HF dimer.
Journal of Molecular Structure-Theochem, 1989, 199, 9-22
IF: 0.858

174. Latajka Zdzisław, Ratajczak Henryk, Person W. B.
On the reliability of SCF ab initio calculations of vibrational frequencies and intensities of hydrogen-bonded systems.
Journal of Molecular Structure, 1989, 194, 89-105
IF: 0.858

175. Moc Jerzy, Latajka Zdzisław, Rudziński J. M., Ratajczak Henryk, Szczęśniak M. M.
Structures and energies of the lithiated silanes.
Journal of the Chemical Society-Perkin Transactions II: Physical Organic Chemistry, 1989, 131-135
IF: 1.106

176. Latajka Zdzisław, Scheiner S.
The potential energy surface and equilibrium geometry of Ar··PH3.
Journal of Molecular Structure, 1989, 198, 205-213
IF: 0.858