A. Pomogaeva

发表

Band structures built by the elongation method.

B. Kirtman, Y. Aoki, F. Gu, 2009, The Journal of chemical physics.

Absorption spectra of estradiol and tryptophan constructed by the statistical and elongation methods.

Yuriko Aoki, Y. Aoki, A. Pomogaeva, 2009, The journal of physical chemistry. A.

Electronic structures and nonlinear optical properties of supramolecular associations of benzo-2,1,3-chalcogendiazoles by the elongation method

A. Imamura, Y. Aoki, F. Gu, 2010 .

Theoretical study on nonlinear optical properties of metalloporphyrin using elongation method

Y. Aoki, F. Gu, A. Pomogaeva, 2010 .

Mechanisms of Hydrogen Generation from Tetrameric Clusters of Lithium Amidoborane.

K. Morokuma, A. Pomogaeva, A. Timoshkin, 2016, The journal of physical chemistry. A.

Initial steps for the thermal decomposition of alkaline-earth metal amidoboranes: a cluster approximation.

A. Pomogaeva, A. Timoshkin, 2016, Physical chemistry chemical physics : PCCP.

Why Do B-P and Al-P Polymers Differ? Structures, Stability, and Electronic Properties of Chain and Ring [H2 PEH2 ]n Oligomers (E=B, Al; n=1-15).

M. Scheer, A. Pomogaeva, A. Timoshkin, 2018, Chemistry.

Group 13–15 Needle-Shaped Oligomers and Nanorods: Structures and Electronic Properties

A. Pomogaeva, A. Timoshkin, 2020 .

Hydrogen atom in water from ambient to high temperatures.

D. Chipman, A. Pomogaeva, 2013, The journal of physical chemistry. B.

New implicit solvation models for dispersion and exchange energies.

D. Chipman, A. Pomogaeva, 2013, The journal of physical chemistry. A.

Modeling short-range contributions to hydration energies with minimal parameterization

D. Chipman, A. Pomogaeva, D. Thompson, 2011 .

Lewis acid stabilized group 13–15 element analogs of ethylene

A. S. Zavgorodnii, A. Pomogaeva, A. Timoshkin, 2022, J. Comput. Chem..

Electronic properties of mixed metal rod-like group 13 nitride oligomers [RMNH]10 and [R3(RMNH)9H3] (M = Al, Ga, In; R = CH3)

A. Pomogaeva, A. Timoshkin, 2014, Theoretical Chemistry Accounts.

Composite method for implicit representation of solvent in dimethyl sulfoxide and acetonitrile.

D. Chipman, A. Pomogaeva, 2015, The journal of physical chemistry. A.

Experimental and theoretical study of the structure of multi-walled carbon nanotubes modified by argon and helium ions

V. V. Bolotov, S. N. Nesov, A. Pomogaeva, 2019, NANOSCIENCE AND NANOTECHNOLOGY: NANO-SciTech.

Hydrogen Activation by Frustrated and Not So Frustrated Lewis Pairs Based on Pyramidal Lewis Acid 9-Boratriptycene: A Computational Study

A. Pomogaeva, A. Timoshkin, 2022, ACS omega.

Reactivity of Oxo- and Thiophosphonium Lewis Acids Towards Acetonitrile and Pyridine

A. Pomogaeva, Fabian Dielmann, A. Timoshkin, 2022, SSRN Electronic Journal.

Thermal Decomposition of Donor-Stabilized Phosphinoborane PH2 BH2 NMe3 : A Tensimetry Study

M. Scheer, A. Pomogaeva, A. Timoshkin, 2019, European Journal of Inorganic Chemistry.

Thermo-dynamical contours of electronic-vibrational spectra simulated using the statistical quantum–mechanical methods

K. Jalkanen, A. Pomogaeva, P. Avramov, 2011 .

Elongation method for calculating excited states of aromatic molecules embedded in polymers

Y. Aoki, F. Gu, A. Pomogaeva, 2009 .

Structures and thermal decomposition of complexes of E(C6F5)3 (E = Al, Ga, In) with pyridine

A. Pomogaeva, A. Timoshkin, N. A. Shcherbina, 2021 .

Structures and Chemical Bonding in Antimony(III) Bromide complexes with Pyridine.

A. Pomogaeva, B. Stöger, A. Timoshkin, 2020, Chemistry.

Structures and Stability of Complexes of E(C 6 F 5 ) 3 (E = B, Al, Ga, In) with Acetonitrile

A. Pomogaeva, A. Timoshkin, O. Khoroshilova, 2020 .

Crystal structures of antimony(III) chloride complexes with pyridine

A. Pomogaeva, A. Timoshkin, E. Peresypkina, 2019, Polyhedron.

Manifestations of Strong Electron Correlation in Polyacene: Fundamental Gap, Density of States, and Photoconductivity

Chong Ju Choi, M. Filatov, A. Pomogaeva, 2022, Carbon Trends.

Field-Extremum Model for Short-Range Contributions to Hydration Free Energy.

D. Chipman, A. Pomogaeva, 2011, Journal of chemical theory and computation.

Hydration Energy from a Composite Method for Implicit Representation of Solvent.

D. Chipman, A. Pomogaeva, 2014, Journal of chemical theory and computation.

Structure and Stability of Hydrogen Compounds of Group 13/15 Elements Stabilized with Lewis Acids and Bases

A. Pomogaeva, A. Timoshkin, A. Lisovenko, 2023, Russian Journal of General Chemistry.

Stability and Electronic Structure of Donor-Acceptor Stabilized Group 13/15 Oligomers.

A. Pomogaeva, A. Timoshkin, 2021, The journal of physical chemistry. A.

Strong Dependence of Structural and Electronic Properties of Rod-Shaped [RGaNH]3n (R = H, CH3) Oligomers on Terminal Groups

A. Pomogaeva, A. Timoshkin, 2015 .

Trimeric cluster of lithium amidoborane—the smallest unit for the modeling of hydrogen release mechanism

Keiji Morokuma, Alexey Y. Timoshkin, Anna V. Pomogaeva, 2016, J. Comput. Chem..

Unusual molecular complexes of antimony fluoride dimers with acetonitrile and pyridine: structures and bonding.

A. Pomogaeva, A. Timoshkin, E. Peresypkina, 2021, Dalton transactions.

Influence of the solvent on the Lewis acidity of antimony pentahalides and group 13 Lewis acids toward acetonitrile and pyridine

Alexey Y. Timoshkin, Anna V. Pomogaeva, A. Pomogaeva, 2021, J. Comput. Chem..

Band structure built from oligomer calculations.

Feng Long Gu, Bernard Kirtman, B. Kirtman, 2008, The Journal of chemical physics.