Contact

All Stories

  1. Synthesis, crystal structure study, characterization, and DFT investigation of a new nickel(II) complex, [dihomopiperazine nickel (II)] sulfate tetrahydrate

    Article • Journal of Molecular Structure, November 2024, Elsevier

    Dr. Aleksey Kuznetsov

  2. Lanthanum nanoparticle decorated carbon nanotubes: Facile method of synthesis and studies of their redox stability, cytotoxicity and corrosion inhibition on the magnesium alloy in 3.5 % NaCl environment

    Article • Diamond and Related Materials, October 2024, Elsevier

    Dr. Aleksey Kuznetsov

  3. Identification of new triazolo annulated dipyridodiazepine derivatives as HIV-1 reverse transcriptase inhibitors: Design, synthesis, DFT, molecular modelling and in silico studies

    Article • Journal of Molecular Structure, October 2024, Elsevier

    Dr. Aleksey Kuznetsov

  4. Samarium functionalized few-layer nano graphene oxide redox behavior, cytotoxicity and corrosion inhibition on Mg AZ31 alloy in 3.5% NaCl environment

    Article • Journal of Molecular Structure, December 2023, Elsevier

    Dr. Aleksey Kuznetsov

  5. Novel Fluorinated Biphenyl Compounds Synthesized via Pd(0)-Catalyzed Reactions: Experimental and Computational Studies

    Article • ACS Omega, August 2023, American Chemical Society (ACS)

    Dr. Aleksey Kuznetsov

  6. Synthesis, In-Silico, In Vitro and DFT Assessments of Substituted Imidazopyridine Derivatives as Potential Antimalarials Targeting Hemoglobin Degradation Pathway

    Article • Journal of Computational Biophysics and Chemistry, July 2023, World Scientific Pub Co Pte Lt

    Dr. Aleksey Kuznetsov

  7. Computational design of the novel building blocks for the metal-organic frameworks based on the organic ligand protected Cu4 cluster

    Article • Physical Sciences Reviews, March 2023, De Gruyter

    Dr. Aleksey Kuznetsov

  8. Using conceptual DFT for studies of metal complexes: some interesting examples

    Article • January 2023, Elsevier

    Dr. Aleksey Kuznetsov

  9. Experimental and DFT studies of selenium decorated graphene oxide: Redox stability, cytotoxicity, and corrosion inhibition of AZ13 Mg alloy

    Article • Materials Chemistry and Physics, December 2022, Elsevier

    Dr. Aleksey Kuznetsov

  10. 3. Core-modified porphyrins: novel building blocks in chemistry

    Article • October 2021, De Gruyter

    Dr. Aleksey Kuznetsov

  11. Introductory Chapter: Azoles, Their Importance, and Applications

    Article • June 2021, IntechOpen

    Dr. Aleksey Kuznetsov

  12. 8 Review of research of nanocomposites based on graphene quantum dots

    Article • June 2021, De Gruyter

    Dr. Aleksey Kuznetsov

  13. Facile synthesis of Tb-decorated graphene oxide: electrochemical stability, hydrogen storage, and corrosion inhibition of Mg AZ13 alloy in 3.5% NaCl medium

    Article • RSC Advances, January 2021, Royal Society of Chemistry

    Professor Dr SIVAKUMAR MANICKAM, Dr. Aleksey Kuznetsov

  14. Experimental and DFT studies of gadolinium decorated graphene oxide materials for their redox properties and as a corrosion inhibition barrier layer on Mg AZ13 alloy in a 3.5% NaCl environment

    Article • RSC Advances, January 2021, Royal Society of Chemistry

    Dr. Aleksey Kuznetsov

  15. Experimental and computational studies of graphene oxide covalently functionalized by octylamine: electrochemical stability, hydrogen evolution, and corrosion inhibition of the AZ13 Mg alloy in 3.5% NaCl

    Article • RSC Advances, January 2020, Royal Society of Chemistry

    Dr. Aleksey Kuznetsov

  16. Experimental and DFT studies of porous carbon covalently functionalized by polyaniline as a corrosion inhibition barrier on nickel-based alloys in acidic media

    Article • RSC Advances, January 2020, Royal Society of Chemistry

    Dr. Aleksey Kuznetsov

  17. Stability of di-butyl-dichalcogenide-capped gold nanoparticles: experimental data and theoretical insights

    Article • RSC Advances, January 2020, Royal Society of Chemistry

    Dr. Aleksey Kuznetsov

  18. Stacks of Metalloporphyrins: Comparison of Experimental and Computational Results

    Article • The Journal of Physical Chemistry B, November 2019, American Chemical Society (ACS)

    Dr. Aleksey Kuznetsov

  19. Phthalocyanines core-modified by P and S and their complexes with fullerene C60: DFT study

    Article • Physical Sciences Reviews, August 2019, De Gruyter

    Dr. Aleksey Kuznetsov

  20. Computational investigations into the structural and electronic properties of CdnTen (n = 1–17) quantum dots

    Article • RSC Advances, January 2019, Royal Society of Chemistry

    Dr. Aleksey Kuznetsov

  21. Experimental and DFT studies of carbon nanotubes covalently functionalized with an imidazole derivative for electrochemical stability and green corrosion inhibition as a barrier layer on the nickel alloy surface in a sulphuric acidic medium

    Article • RSC Advances, January 2019, Royal Society of Chemistry

    Dr. Aleksey Kuznetsov

  22. 9. Complexes between core-modified porphyrins ZnP(X)4 (X = P and S) and small semiconductor nanoparticle Zn6S6: are they possible?

    Article • December 2018, De Gruyter

    Dr. Aleksey Kuznetsov

  23. Complexes between core-modified porphyrins ZnP(X)4 (X = P and S) and small semiconductor nanoparticle Zn6S6: are they possible?

    Article • Physical Sciences Reviews, September 2018, De Gruyter

    Dr. Aleksey Kuznetsov

  24. Three Ligands with Biomedical Importance: Binding to Small ZnS Quantum Dots

    Article • The Journal of Physical Chemistry C, May 2018, American Chemical Society (ACS)

    Dr. Aleksey Kuznetsov

  25. Facile Synthesis and Characterization of Symmetric N-[(Phenylcarbonyl) carbamothioyl]benzamide Thiourea: Experimental and Theoretical Investigations

    Article • Journal of the Brazilian Chemical Society, January 2018, Sociedade Brasileira de Quimica (SBQ)

    Dr. Aleksey Kuznetsov, Prof. Javier Alcides Ellena

  26. Influence of an exciton-delocalizing ligand on the structural, electronic, and spectral features of the Cd33S33 quantum dot: insights from computational studies

    Article • Journal of Materials Chemistry C, January 2018, Royal Society of Chemistry

    Dr. Aleksey Kuznetsov

  27. Can MP(P)4 Compounds Form Complexes with C60?

    Article • Journal of Applied Solution Chemistry and Modeling, November 2017, Lifescience Global

    Dr. Aleksey Kuznetsov, Lifescience Global Inc.

  28. Design of Novel Classes of Building Blocks for Nanotechnology: Core‐Modified Metalloporphyrins and Their Derivatives

    Article • August 2017, IntechOpen

    Dr. Aleksey Kuznetsov

  29. Phytotoxicity, structural and computational analysis of 2-methyl-1,5-diarylpentadienones

    Article • Journal of Molecular Structure, August 2017, Elsevier

    Dr. Aleksey Kuznetsov

  30. Structural isomerism of Ru(ii)-carbonyl complexes: synthesis, characterization and their antitrypanosomal activities

    Article • New Journal of Chemistry, January 2017, Royal Society of Chemistry

    Prof. Javier Alcides Ellena, Dr. Aleksey Kuznetsov

  31. Computational design of ZnP(P)4 stacks: Three modes of binding

    Article • Journal of Theoretical and Computational Chemistry, August 2016, World Scientific Pub Co Pte Lt

    Dr. Aleksey Kuznetsov

  32. How the change of the ligand from L = porphine, P 2− , to L = P 4 -substituted porphine, P(P) 4 2− , affects the electronic properties and the M–L binding energies for the first-row transition metals M = Sc–Zn: Comparative study

    Article • Chemical Physics, May 2016, Elsevier

    Dr. Aleksey Kuznetsov

  33. Metalloporphyrins with all the pyrrole nitrogens replaced with phosphorus atoms, MP(P) 4 (M = Sc, Ti, Fe, Ni, Cu, Zn)

    Article • Chemical Physics, February 2015, Elsevier

    Dr. Aleksey Kuznetsov

  34. Anti-Mycobacterium tuberculosisand Cytotoxicity Activities of Ruthenium(II)/Bipyridine/Diphosphine/Pyrimidine-2-thiolate Complexes: The Role of the Non-CoordinatedN-Atom

    Article • Journal of the Brazilian Chemical Society, January 2015, Sociedade Brasileira de Quimica (SBQ)

    Prof. Javier Alcides Ellena, Dr. Aleksey Kuznetsov

  35. Structural and Electronic Properties of Bare and Capped Cd33Se33 and Cd33Te33 Quantum Dots

    Article • The Journal of Physical Chemistry C, March 2014, American Chemical Society (ACS)

    Dr. Aleksey Kuznetsov

  36. Distance-Independent Charge Recombination Kinetics in Cytochrome c–Cytochrome c Peroxidase Complexes: Compensating Changes in the Electronic Coupling and Reorganization Energies

    Article • The Journal of Physical Chemistry B, July 2013, American Chemical Society (ACS)

    Dr. Aleksey Kuznetsov

  37. Effects of S-containing ligands on the structure and electronic properties of CdnSen/CdnTen nanoparticles (n=3, 4, 6, and 9)

    Article • Chemical Physics, October 2012, Elsevier

    Dr. Aleksey Kuznetsov

  38. Structural and Electronic Properties of Bare and Capped CdnSen/CdnTen Nanoparticles (n = 6, 9)

    Article • The Journal of Physical Chemistry C, March 2012, American Chemical Society (ACS)

    Dr. Aleksey Kuznetsov

  39. Revealing substituent effects on the electronic structure and planarity of Ni-porphyrins

    Article • Computational and Theoretical Chemistry, February 2012, Elsevier

    Dr. Aleksey Kuznetsov

  40. The role of the heteroatom (X = SiIV, PV, and SVI) on the reactivity of {γ-[(H2O)RuIII(μ-OH)2RuIII(H2O)][X n+W10O36]}(8−n)− with the O2 molecule

    Article • Theoretical Chemistry Accounts, May 2011, Springer Science + Business Media

    Dr. Aleksey Kuznetsov

  41. Polyoxometalates in the Design of Effective and Tunable Water Oxidation Catalysts

    Article • Israel Journal of Chemistry, February 2011, Wiley

    Dr. Aleksey Kuznetsov

  42. Insights into the Mechanism of O2Formation and Release from the Mn4O4L6“Cubane” Cluster

    Article • The Journal of Physical Chemistry A, November 2010, American Chemical Society (ACS)

    Dr. Aleksey Kuznetsov

  43. Aza-β3-amino acid containing peptidomimetics as cAMP-dependent protein kinase substrates

    Article • Bioorganic Chemistry, October 2010, Elsevier

    Dr. Aleksey Kuznetsov

  44. ChemInform Abstract: On the Aromaticity of Square Planar Ga42- and In42- in Gaseous NaGa4- and NaIn4- Clusters.

    Article • ChemInform, May 2010, Wiley

    Dr. Aleksey Kuznetsov

  45. ChemInform Abstract: On the Resonance Energy in New All-Metal Aromatic Molecules

    Article • ChemInform, May 2010, Wiley

    Dr. Aleksey Kuznetsov

  46. A Fast Soluble Carbon-Free Molecular Water Oxidation Catalyst Based on Abundant Metals

    Article • Science, March 2010, American Association for the Advancement of Science

    Dr. Aleksey Kuznetsov

  47. Does the MgO(100)-Support Facilitate the Reaction of Nitrogen and Hydrogen Molecules Catalyzed by Zr2Pd2Clusters? A Computational Study

    Article • Inorganic Chemistry, March 2010, American Chemical Society (ACS)

    Dr. Aleksey Kuznetsov

  48. Computational Studies of the Geometry and Electronic Structure of an All-Inorganic and Homogeneous Tetra-Ru-Polyoxotungstate Catalyst for Water Oxidation and Its Four Subsequent One-Electron Oxidized Forms

    Article • The Journal of Physical Chemistry A, January 2010, American Chemical Society (ACS)

    Dr. Aleksey Kuznetsov

  49. ChemInform Abstract: Dioxygen and Water Activation Processes on Multi-Ru-Substituted Polyoxometalates: Comparison with the “Blue-Dimer” Water Oxidation Catalyst

    Article • ChemInform, August 2009, Wiley

    Dr. Aleksey Kuznetsov

  50. Dioxygen and Water Activation Processes on Multi-Ru-Substituted Polyoxometalates: Comparison with the “Blue-Dimer” Water Oxidation Catalyst

    Article • Journal of the American Chemical Society, May 2009, American Chemical Society (ACS)

    Dr. Aleksey Kuznetsov

  51. Mechanism of the Divanadium-Substituted Polyoxotungstate [γ-1,2-H2SiV2W10O40]4−Catalyzed Olefin Epoxidation by H2O2: A Computational Study

    Article • Inorganic Chemistry, March 2009, American Chemical Society (ACS)

    Dr. Aleksey Kuznetsov

  52. Mass-selected Ag3 clusters soft-landed onto MgO/Mo(100): femtosecond photoemission and first-principles simulations

    Article • The European Physical Journal D, September 2007, Springer Science + Business Media

    Dr. Aleksey Kuznetsov

  53. Optical properties of small silver clusters supported at MgO

    Article • The European Physical Journal D, May 2007, Springer Science + Business Media

    Dr. Aleksey Kuznetsov

  54. Multiple Aromaticity and Antiaromaticity in Silicon Clusters

    Article • ChemPhysChem, December 2004, Wiley

    Dr. Aleksey Kuznetsov

  55. A single π-bond captures 3, 4 and 5 atoms

    Article • Chemical Physics Letters, April 2004, Elsevier

    Dr. Aleksey Kuznetsov

  56. All-Metal Antiaromatic Molecule: Rectangular Al4-4 in the Li3Al-4 Anion.

    Article • ChemInform, July 2003, Wiley

    Dr. Aleksey Kuznetsov

  57. All-Metal Antiaromatic Molecule: Rectangular Al44- in the Li3Al4- Anion

    Article • Science, April 2003, American Association for the Advancement of Science

    Dr. Aleksey Kuznetsov

  58. Peculiar Antiaromatic Inorganic Molecules of Tetrapnictogen in Na+Pn4- (Pn = P, As, Sb) and Important Consequences for Hydrocarbons

    Article • Inorganic Chemistry, October 2002, American Chemical Society (ACS)

    Dr. Aleksey Kuznetsov

  59. Al62-− Fusion of Two Aromatic Al3-Units. A Combined Photoelectron Spectroscopy and ab Initio Study of M+[Al62-] (M = Li, Na, K, Cu, and Au)

    Article • Journal of the American Chemical Society, October 2002, American Chemical Society (ACS)

    Dr. Aleksey Kuznetsov

  60. Peculiar Transformation of a Nonaromatic Al4Cl4(NH3)4into an Aromatic Na2Al4Cl4(NH3)4

    Article • Inorganic Chemistry, July 2002, American Chemical Society (ACS)

    Dr. Aleksey Kuznetsov

  61. Probing the Electronic Structure and Aromaticity of Pentapnictogen Cluster Anions Pn5-(Pn = P, As, Sb, and Bi) Using Photoelectron Spectroscopy and ab Initio Calculations

    Article • The Journal of Physical Chemistry A, June 2002, American Chemical Society (ACS)

    Dr. Aleksey Kuznetsov

  62. On the Resonance Energy in New All-Metal Aromatic Molecules

    Article • Inorganic Chemistry, February 2002, American Chemical Society (ACS)

    Dr. Aleksey Kuznetsov

  63. Article • Structural Chemistry, January 2002, Springer Science + Business Media

    Dr. Aleksey Kuznetsov

  64. Aromatic Mercury Clusters in Ancient Amalgams

    Article • Angewandte Chemie, September 2001, Wiley

    Dr. Aleksey Kuznetsov

  65. Aromatic Mercury Clusters in Ancient Amalgams

    Article • Angewandte Chemie International Edition, September 2001, Wiley

    Dr. Aleksey Kuznetsov

  66. On the Aromaticity of Square Planar Ga42-and In42-in Gaseous NaGa4-and NaIn4-Clusters

    Article • Journal of the American Chemical Society, September 2001, American Chemical Society (ACS)

    Dr. Aleksey Kuznetsov

  67. Experimental and Theoretical Observations of Aromaticity in Heterocyclic XAl3 (X=Si, Ge, Sn, Pb) Systems

    Article • Angewandte Chemie International Edition, May 2001, Wiley

    Dr. Aleksey Kuznetsov

  68. Experimental and Theoretical Observations of Aromaticity in Heterocyclic XAl3− (X=Si, Ge, Sn, Pb) Systems

    Article • Angewandte Chemie International Edition, May 2001, Wiley

    Dr. Aleksey Kuznetsov

  69. ChemInform Abstract: Observation of All-Metal Aromatic Molecules.

    Article • ChemInform, May 2001, Wiley

    Dr. Aleksey Kuznetsov

  70. Observation of All-Metal Aromatic Molecules

    Article • Science, February 2001, American Association for the Advancement of Science

    Dr. Aleksey Kuznetsov