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Showing 1 to 12 of 46 entries
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Effective and accurate approach for modeling of commensurate-incommensurate transition in krypton monolayer on graphite.

The Journal of chemical physics

Ustinov EA.
PMID: 25296827
J Chem Phys. 2014 Oct 07;141(13):134706. doi: 10.1063/1.4897163.

Commensurate-incommensurate (C-IC) transition of krypton molecular layer on graphite received much attention in recent decades in theoretical and experimental researches. However, there still exists a possibility of generalization of the phenomenon from thermodynamic viewpoint on the basis of accurate...

Two-dimensional order-disorder transition of argon monolayer adsorbed on graphitized carbon black: kinetic Monte Carlo method.

The Journal of chemical physics

Ustinov EA, Do DD.
PMID: 22482575
J Chem Phys. 2012 Apr 07;136(13):134702. doi: 10.1063/1.3698194.

We present results of application of the kinetic Monte Carlo technique to simulate argon adsorption on a graphite surface at temperatures below and above the triple point. We show that below the triple point the densification of the adsorbed...

[Peculiarities of disorders in physical development of children consuming drinking water with increased nitrate content].

Voprosy pitaniia

Luzhetskiy KP, Ustinova OY, Vandysheva AY, Chigvintsev VM.
PMID: 30645861
Vopr Pitan. 2017;86(3):40-48. doi: 10.24411/0042-8833-2017-00043. Epub 2017 May 02.

Peculiarities of physical development disorders in 334 children were examined in the course of comparative clinical-laboratory research; all these children consumed drinking water with various nitrates content (11.2±1.1 mg/l and up to 3.14 MPC, i.e. 141 mg/l), in a...

Modeling of N2 adsorption in MCM-41 materials: hexagonal pores versus cylindrical pores.

Langmuir : the ACS journal of surfaces and colloids

Ustinov EA.
PMID: 19358591
Langmuir. 2009 Jul 07;25(13):7450-6. doi: 10.1021/la900369b.

Low-temperature nitrogen adsorption in hexagonal pores and equivalent cylindrical pores is analyzed using nonlocal density functional theory extended to amorphous solids (NLDFT-AS). It is found that, despite significant difference of the density distribution over the cross-section of the pore,...

Partial Substitution of Pb.

ACS applied materials & interfaces

Ustinova MI, Mikheeva MM, Shilov GV, Dremova NN, Frolova L, Stevenson KJ, Aldoshin SM, Troshin PA.
PMID: 33474932
ACS Appl Mater Interfaces. 2021 Feb 03;13(4):5184-5194. doi: 10.1021/acsami.0c18061. Epub 2021 Jan 21.

All-inorganic lead halide perovskites, for example, CsPbI

Nitrogen adsorption on silica surfaces of nonporous and mesoporous materials.

Langmuir : the ACS journal of surfaces and colloids

Ustinov EA.
PMID: 18533689
Langmuir. 2008 Jun 01;24(13):6668-75. doi: 10.1021/la704011z. Epub 2008 Jun 06.

We present an accurate comparative analysis of N 2 adsorption at 77 K on nonporous silica and the pore wall surface of MCM-41 materials. The analysis shows that in the low-pressure region of N 2 adsorption obeys a peculiar...

Incorporation of Vanadium(V) Oxide in Hybrid Hole Transport Layer Enables Long-term Operational Stability of Perovskite Solar Cells.

The journal of physical chemistry letters

Tepliakova MM, Mikheeva AN, Frolova LA, Boldyreva AG, Elakshar A, Novikov AV, Tsarev SA, Ustinova MI, Yamilova OR, Nasibulin AG, Aldoshin SM, Stevenson KJ, Troshin PA.
PMID: 32564599
J Phys Chem Lett. 2020 Jul 16;11(14):5563-5568. doi: 10.1021/acs.jpclett.0c01600. Epub 2020 Jun 30.

Recent studies have shown that charge transport interlayers with low gas permeability can increase the operational lifetime of perovskite solar cells serving as a barrier for migration of volatile decomposition products from the photoactive layer. Herein we present a...

Thermodynamics, EOS, and heat capacity in molecular modeling of self-assembled molecular layers.

The Journal of chemical physics

Ustinov E.
PMID: 33261477
J Chem Phys. 2020 Nov 28;153(20):204105. doi: 10.1063/5.0031103.

Self-assembled monolayers (SAMs) on solid surfaces represent a rapidly developed class of non-autonomous phases widely used in organic electronics, sensors, catalysis, and other applications. In many cases, the same organic molecules form various stable and metastable polymorphous structures that...

[Water-load compimetric test in early diagnosis of glaucoma].

Vestnik oftalmologii

USTINOVA EI.
PMID: 13477950
Vestn Oftalmol. 1957 Jul-Aug;70(4):41-5.

No abstract available.

Efficient chemical potential evaluation with kinetic Monte Carlo method and non-uniform external potential: Lennard-Jones fluid, liquid, and solid.

The Journal of chemical physics

Ustinov EA.
PMID: 28688449
J Chem Phys. 2017 Jul 07;147(1):014105. doi: 10.1063/1.4991324.

The aim of this paper is to present a method of a direct evaluation of the chemical potential of fluid, liquid, and solid with kinetic Monte Carlo simulation. The method is illustrated with the 12-6 Lennard-Jones (LJ) system over...

Reductions in Kinematics from Brassieres with Varying Breast Support.

International journal of exercise science

Gibson TM, Balendra N, Ustinova KI, Langenderfer JE.
PMID: 30899340
Int J Exerc Sci. 2019 Mar 01;12(1):402-411. eCollection 2019.

Given the abundance of brassieres, manufacturers, and investigations of bras, it remains unclear whether the continued development of bras will provide many additional improvements in support. This study measured performance of sport bras including 4 popular bras and a...

Phase equilibrium in argon films stabilized by homogeneous surfaces and thermodynamics of two-stage melting transition.

The Journal of chemical physics

Ustinov EA.
PMID: 24559359
J Chem Phys. 2014 Feb 21;140(7):074706. doi: 10.1063/1.4865751.

Freezing of gases adsorbed on open surfaces (e.g., graphite) and in narrow pores is a widespread phenomenon which is a subject of a large number of publications. Modeling of the gas/liquid-solid transition is usually accomplished with a molecular simulation...

Showing 1 to 12 of 46 entries