List of publications of Dr. Nurbosyn U. Zhanpeisov
1. N.U. Zhanpeisov, M. Anpo. Hydrogen bonding versus coordination of adsorbate
molecules on Ti-silicalites: A density functional theory study. J. Am. Chem. Soc. 126 (2004) 9439-9444.
2. I.L. Zilberberg, N.U. Zhanpeisov. Preface. Res. Chem. Intermed. 30 (2004) 1-4. 3. N.U. Zhanpeisov, K. Tsujimaru, M. Anpo. Intrinsic band gap in semiconductor
oxides and Ti-silicalite: ab initio and DFT study. Res. Chem. Intermed. 30 (2004) 121-132.
4. N.U. Zhanpeisov. A density functional theory study of the oxidation of methanol
to formaldehyde over vanadia supported on silica, titania and zirconia. Res. Chem. Intermed. 30 (2004) 133-142.
5. N.U. Zhanpeisov, K. Mizuno, M. Anpo, J. Leszczynski. C1-C2 bond cleavage in
vinylidenecyclopropanes: Theoretical density functional theory study. Int. J. Quantum Chem. 96 (2004) 343-348.
Zhanpeisov, Y. Kanazawa, H. Yamashita, M. Anpo. Intrinsic band gap shift
in Ti silicalites modified by V ion implantation: ab initio and density functional theory study. Int. J. Quantum Chem. 96 (2004) 349-354.
7. N.U. Zhanpeisov, W.S. Ju, K. Iino, M. Matsuoka, M. Anpo. Local structure of
highly dispersed lead species incorporated within zeolite: experimental and theoretical studies. Res. Chem. Intermediat. 29 (2003) 407-416.
8. N.U. Zhanpeisov, A. Miyamoto. Interactions of water and methanol with a
mixture of copper and zinc metals: a theoretical ab initio study. Res. Chem. Intermediat. 29 (2003) 417-428.
9. N.U. Zhanpeisov, G. Martra, W.S. Ju, M. Matsuoka, S. Coluccia, M. Anpo.
Interaction of N2O with Ag+ ion-exchanged zeolites: an FT-IR spectroscopy and quantum chemical ab initio and DFT studies. J. Mol. Catal. A: Chemical 201 (2003) 237-246.
10. N.U. Zhanpeisov, W.S. Ju, M. Matsuoka, M. Anpo. Quantum chemical
calculations on the structure and adsorption properties of NO and N2O on Ag+ and Cu+ ion-exchanged zeolites. Struct. Chem. 14 (2003) 247-255.
11. M. Anpo, S. Higashimoto, M. Matsuoka, N. Zhanpeisov, Y. Shioya, S. Dzwigaj,
M. Che. Corrigendum to “The effect of the framework structure on the chemical properties of the vanadium oxide species incorporated within zeolites.” Catal. Today 86 (2003) 287-288.
12. M. Anpo, S. Higashimoto, M. Matsuoka, N. Zhanpeisov, Y. Shioya, S. Dzwigaj,
M. Che. The effect of the framework structure on the chemical properties of the vanadium oxide species incorporated within zeolites. Catal. Today 78 (2003) 211-217.
13. N.U. Zhanpeisov, A. Sugimoto, K. Mizuno, M. Anpo, J. Leszczynski. Thermal
instability of 5-(9-anthrylmethyl)-10-methyl-5,10-dihydrophenazine. A quantum chemical DFT study. J. Mol. Struct. (Theochem) 592 (2002) 149-153.
14. N.U. Zhanpeisov, W.S. Ju, M. Anpo. Local structure of highly dispersed lead
containing zeolite. An ab initio and density functional theory study. J. Mol. Struct. (Theochem) 592 (2002) 155-160.
15. N.U. Zhanpeisov, M. Anpo. Combined cluster quantum chemical MINDO/3 and
ab initio study on zinc phosphate structures. Struct. Chem. 12 (2001) 399-403.
16. N.U. Zhanpeisov, S. Higashimoto, M. Anpo. Selective catalytic reduction of nitric
oxide with ammonia: A theoretical ab initio study. Int. J. Quantum Chem. 84 (2001) 677-685.
17. N.U. Zhanpeisov, J. Leszczynski. Hydration of DNA bases and compounds
containing small rings – a model for interactions of the ricin toxin A-chain. A theoretical ab initio study. Struct. Chem. 12 (2001) 121-126.
18. N.U. Zhanpeisov, M. Harada, M. Anpo. The nature of the active sites of titanium
oxide photocatalysts stabilized on an active carbon surface. A theoretical ab initio study. J. Mol. Struct. (Theochem) 529 (2000) 135-139.
19. H. Zhou, H. Tamura, S. Takami, M. Kubo, N. Zhanpeisov, A. Miyamoto.
Adsorption properties of CH3OH on Al(111) and Fe(100) surfaces: A periodic first-principles investigation. Jpn. J. Appl. Phys. 39 (2000) 4275-4278.
20. N.U. Zhanpeisov and M. Anpo. Theoretical ab initio studies of the interaction of
molecules with transition metals containing zeolites and silicalites: A case study of the interaction of NO molecules. In: Photofunctional Zeolites: Synthesis, Characterization, Photocatalytic Reactions, Light Harvesting. Eds. M. Anpo, Nova Science Publ., Inc., Huntington, New-York, Chapter 3, (2000) 75-97.
21. H. Zhou, H. Tamura, S. Takami, M. Kubo, R. Belosludov, N. Zhanpeisov, A.
Miyamoto. Periodic density functional study on adsorption properties of organic molecules on clen Al(111) surface. Appl. Surf. Sci. 158 (2000) 38-42.
22. N.U. Zhanpeisov, J. Leszczynski. Specific solvation effects on the structures and
properties of neutral and one-electron oxidized formamidine-formamide complexes. A theoretical ab initio study. J. Phys. Chem. A 103 (1999) 8317-8327.
23. N.U. Zhanpeisov, J. Leszczynski. Specific solvation effects on the structures and
properties of Watson-Crick and reverse Watson-Crick isocytosine-cytosine and guanine-cytosine base pairs: a theoretical ab initio study. J. Mol. Struct. (Theochem) 487 (1999) 107-115.
24. N.U. Zhanpeisov, J.W. Adams, S.L. Larson, C.A. Weiss, Jr., B.Zh. Zhanpeisova,
D. Leszczynska, J. Leszczynski. Cluster quantum chemical study of triaminotoluene interaction with a model clay surface. Struct. Chem. 10 (1999) 285-294.
25. N.U. Zhanpeisov, W.W. Cox, Jr., J. Leszczynski. Theoretical quantum chemical
study of tautomerism and proton transfer in 6,8-dithioguanine. J. Phys. Chem. A 103 (1999) 4564-4571.
26. N.U. Zhanpeisov, J. Sponer, J. Leszczynski. Reverse Watson-Crick isocytosine-
cytosine and guanine-cytosine base pairs stabilized by the formation of the minor tautomers of bases. An ab initio study in the gas phase and in a water cluster. J. Phys. Chem. A 102 (1998) 10374-10379.
27. N.U. Zhanpeisov, M. Matsuoka, H. Mishima, H. Yamashita, M. Anpo. Interaction
of NO molecules with a copper-containing zeolite. A theoretical ab initio study. J. Mol. Struct. (Theochem) 454 (1998) 201-207.
28. N.U. Zhanpeisov, J. Leszczynski. Specific solvation effects on structures and
properties of isocytosine-cytosine complexes: A theoretical ab initio study. J. Phys. Chem. B 102 (1998) 9109-9118.
29. N.U. Zhanpeisov, M. Matsuoka, H. Yamashita, M. Anpo. Cluster quantum
chemical ab initio study on the interaction of NO molecules with highly dispersed titanium oxides incorporated into silicalite and zeolites. J. Phys. Chem. B 102 (1998) 6915-6920.
30. N.U. Zhanpeisov, J. Leszczynski. The specific solvation effects on the structures
and properties of adenine-uracil complexes: A theoretical ab initio study. J. Phys. Chem. A 102 (1998) 6167-6172.
31. N.U. Zhanpeisov, J. Leszczynski. Ab initio study of the structure of isocytosine-
cytosine standard Watson-Crick base pairs in the gas phase and in water. Int. J. Quantum Chem. 69 (1998) 37-47.
32. A. Jabalameli, N.U. Zhanpeisov, A. Nowek, R.H. Sullivan, J. Leszczynski.
Interactions of hydroxyurea with a water molecule. Ab initio molecular orbital study. J. Phys. Chem. A 101 (1997) 3619-3625.
33. N.U. Zhanpeisov, H. Nakatsuji, M. Hada, M. Yoshimoto. Cluster quantum
chemical MINDO/3 study of HCOOH interactions with nonpolar (10ī0) surface of ZnO. J. Mol. Catal. A: Chemical 118 (1997) 69-77.
34. N.U. Zhanpeisov, H. Nakatsuji, M. Hada, H. Nakai, M. Anpo. CO and NO
adsorption on copper-containing zeolite. A theoretical ab initio study. Catal. Lett. 42 (1996) 173-176.
35. N.U. Zhanpeisov, H. Nakatsuji, M. Hada. Cluster quantum chemical MINDO/3
study on the nature of hydroxyl groups on a calcium oxide surface. J. Mol. Catal. A: Chemical 112 (1996) 63-67.
36. N.U. Zhanpeisov, T. Bredow, K. Jug. Quantum chemical SINDO1 study of
vanadium pentoxide. Catal. Lett. 39 (1996) 111-118.
37. G.M. Zhidomirov, N.U. Zhanpeisov, I.L. Zilberberg, I.V. Yudanov. On some
ways of modifying semiempirical quantum chemical methods. Int. J. Quantum Chem. 58 (1996) 175-184.
38. N.U. Zhanpeisov, V. Staemmler, M. Baerns. A quantum chemical MINDO/3
study of methane and oxygen interactions with a pure and a modified calcium oxide surface. J. Mol. Catal. A: Chemical 101 (1995) 51-60.
39. N.U. Zhanpeisov, M. Baerns. Cluster quantum chemical study of the
chemisorption of methane on a lithium promoted magnesium oxide doped by zinc oxide. J. Mol. Catal. A: Chemical 99 (1995) 139-142.
40. G.M. Zhidomirov, V.I. Avdeev, N.U. Zhanpeisov, I.I. Zakharov, I.V. Yudanov.
Molecular models of active sites of C1 and C2 hydrocarbon activation. Catal. Today 24 (1995) 383-387.
41. N.U. Zhanpeisov, G.M. Zhidomirov, M. Baerns. Cluster quantum chemical study
of the chemisorption of methane on zinc oxide surface. J. Mol. Catal. A: Chemical 99 (1995) 35-39.
42. N.U. Zhanpeisov, E.A. Paukshtis, G.M. Zhidomirov, V.A. Zakharov. Quantum
chemical cluster investigation of the interaction of carbon monoxide and surface acid centers of highly dispersed magnesium chloride. Russ. Kinet. Catal. 36 (1995) 187-190.
43. N.U. Zhanpeisov, E.A. Paukshtis, G.M. Zhidomirov, V.A. Zakharov. Cluster
quantum chemical study of the interaction of carbon monoxide with surface acid centers of highly dispersed magnesium chloride. Catal. Lett. 29 (1994) 209-215.
44. N.U. Zhanpeisov, G.M. Zhidomirov, I.V. Yudanov, K.J. Klabunde. Cluster
quantum chemical study of the interaction of dimethyl methylphosphonate with magnesium oxide. J. Phys. Chem. 98 (1994) 10032-10035.
45. N.U. Zhanpeisov, G.M. Zhidomirov, M. Baerns. Cluster quantum chemical study
of the interaction between a carbon monoxide molecule and a zinc oxide surface. Rus. J. Struct. Chem. 35 (1994) 9-12.
46. N.U. Zhanpeisov, K. Otsuka. Cluster quantum chemical study of the mechanism
of selective oxidation of ethane to acetaldehyde on boron-phosporus mixed oxide catalysts. 2. Influence of additives. React. Kinet. Catal. Lett. 52 (1994) 27-33.
47. E.B. Burgina, V.P. Baltakhinov, E.V. Boldyreva, E.S. Stoyanov, N.U. Zhanpeisov
G.M. Zhidomirov. Effect of high pressure on the vibration spectrum of nitromethane molecules: changes in the kinematics of the vibrations as a result of the decrease in the distance between the molecules. J. Mol. Struct. 296 (1993) 53- 59.
48. I.S. Irgibaeva, V.A. Benderskii, G.M. Zhidomirov, N.U. Zhanpeisov. MINDO/3
simulation of electro-chemical hydrogen evolution reaction. Adsorption of hydrogen atoms on a mercury surface. Russ. Electrochem. 28 (1992) 967-971.
49. N.U. Zhanpeisov, K. Otsuka. Cluster quantum chemical study of the mechanism
of selective oxidation of ethane to acetaldehyde on boron-phosphorus mixed oxide catalysts. React. Kinet. Catal. Lett. 48 (1992) 301-308.
50. N.U. Zhanpeisov, A.G. Pelmenschikov, G.M. Zhidomirov. Quantum chemical
study of the nature of hydroxy groups on an MgO surface. Mendeleev Commun. (1992) 148-149.
51. G.M. Zhidomirov, N.U. Zhanpeisov. Quantum chemical study of complexes with
hydrogen bonds. Russ. Chem. Phys. 11 (1992) 670-677.
52. N.U. Zhanpeisov, G.M. Zhidomirov. Parametrization of the semiempirical
MINDO/3 quantum chemical method for zinc containing compounds. Russ. J. Struct. Chem. 33 (1992) 128-130.
53. G.M. Zhidomirov, N.U. Zhanpeisov. Active centers of magnesium oxide surface
and calculations of dissociative chemisorption of methane on modified MgO. Catal. Today. 13 (1992) 517-522.
54. N.U. Zhanpeisov, G.M. Zhidomirov. Molecular structure of a surface superoxide
radical-anion on MgO. Mendeleev Commun. (1992) 111-113.
55. N.U. Zhanpeisov, G.M. Zhidomirov. Cluster quantum chemical study of
dihydrogen, methane and water molecules interactions with a pure and lithium doped magnesium oxide. In: Physics and Chemistry of Finite Systems: From Clusters to Crystals. Eds. P. Jena, S. Khanna, B. Rao. Vol. 2 (1992) 1177-1182.
56. N.U. Zhanpeisov, A.G. Pelmenschikov, G.M. Zhidomirov. Cluster quantum
chemical study of the reaction of molecules with a magnesium oxide surface. 2. Molecular and dissociative adsorption of H2O. Russ. Kinet. Catal. 32 (1991) 875- 877.
57. N.U. Zhanpeisov, A.G. Pelmenschikov, G.M. Zhidomirov. Cluster quantum
chemical study of interaction of molecules with a magnesium oxide surface. 1. Dissociative chemisorption of hydrogen and methane molecules. Russ. Kinet. Catal. 31 (1990) 491-496.
58. O.V. Gritsenko, S.V. Danilova, N.U. Zhanpeisov, V.G. Malkin, G.M. Zhidomirov
A combined method of SCF MO LCAO and correlation density functional as applied to adsorption of atomic hydrogen by lithium clusters. Russ. Theor. Exp. Chem. 25 (1989) 385-392.
59. N.U. Zhanpeisov, G.M. Zhidomirov. Application of MINDO/3-HB method to
evaluation of activation energy of intramolecular proton transfer in malonaldehyde. React. Kinet. Catal. Lett. 38 (1989) 395-397.
60. G.V. Tsintsadze, G.M. Zhidomirov, M.A. Meladze, N.U. Zhanpeisov, E.A.
Kvesereli, A.G. Pelmenschikov, A.P. Narimanidze. Quantum chemical study of the proton acceptor properties of amides and hydrazides of nicotinic and isonicotinic acids. Bull. Russ. Acad. Sci. Chemical (1988) 810-812.
61. G.M. Zhidomirov, A.G. Pelmenschikov, N.U. Zhanpeisov, A.G. Grebenyuk.
Cluster approach to quantum chemical calculations of chemisorption and heterogeneous catalytic systems. Russ. Kinet. Catal. 28 (1987) 86-99.
62. N.U. Zhanpeisov, A.G. Pelmenschikov, E.A. Paukshtis, G.M. Zhidomirov. A
quantum chemical study of the formation mechanisms of pyridinium ion on alumina-silica surface and in liquid phase. Russ. Kinet. Catal. 28 (1987) 194-198.
63. N.U. Zhanpeisov, A.G. Pelmenschikov, G.M. Zhidomirov. A modified form of
the MINDO/3 method for hydrogen bonded complexes. Russ. J. Struct. Chem. 28 (1987) 1-5.
64. A.G. Pelmenschikov, E.A. Paukshtis, N.U. Zhanpeisov, V.I. Pavlov, G.M.
Zhidomirov. Comparative discussion of NH +
surfaces and in acidic media. React. Kinet. Catal. Lett. 33 (1987) 423-428.
65. A.G. Pelmenschikov, N.U. Zhanpeisov, E.A. Paukshtis, L.V. Malysheva, G.M.
Zhidomirov, K.I. Zamaraev. On the nature of transition state in reactions of proton acid heterogeneous organic catalysis. Bull. Russ. Acad. Sci. 293 (1987) 910-920.
66. O.V. Gritsenko, S.V. Danilova, N.U. Zhanpeisov, V.G. Malkin, G.M. Zhidomirov
On the evaluation of the correlation energy and the total non-relativistic Born- Oppenheimer energy for the water molecule. Chem. Phys. Lett. 134 (1987) 423- 427.
67. N.U. Zhanpeisov, M.B. Muratbekov, B.A. Beremzhanov, G.M. Zhidomirov.
Energetic effects of some radical reactions of phosphinates, phosphonates and phosphates as calculated by a semiempirical quantum chemical MINDO/3 method. Bull. Kazakh Acad. Sci. Chemical (1986) 37-42.
68. N.U. Zhanpeisov, M.B. Muratbekov, B.A. Beremzhanov, G.M. Zhidomirov.
Semiempirical quantum chemical MINDO/3 study of phosphinates, phosphonates and phosphates as well as their free-radical derivatives. Bull. Kazakh Acad. Sci. Chemical (1986) 72-78.
69. G.V. Tsintsadze, G.M. Zhidomirov, E.A. Kvesereli, A.G. Pelmenschikov, M.A.
Meladze, N.U. Zhanpeisov. Quantum chemical study of peptide bond properties in a protonated formamide. Bull. Russ. Acad. Sci. Chemical (1985) 2617-2619.
70. N.U. Zhanpeisov, M.B. Muratbekov, B.A. Beremzhanov. Semiempirical quantum
chemical CNDO/2 study of three-fold and four-fold coordinated radicals formed from phosphinate and phosphonate. Bull. Kazakh. Acad. Sci. Chemical (1983) 3-8.
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