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A simple semiempirical model for the static polarizability of ions

Chinese physics B, 2023-07, Vol.32 (8), p.83301-49

2023

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A simple semiempirical model for the static polarizability of electronically excited atoms and molecules

Chinese physics B, 2023-03, Vol.32 (4), p.43301-340

2023

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Molecular Collision Diameters and Electronic Polarizabilities: Inherent Relationship and Fast Evaluation

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2021-06, Vol.125 (23), p.5117-5123

2021

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Toward size-dependent thermodynamics of nanoparticles from quantum chemical calculations of small atomic clusters: a case study of (BO)

Physical chemistry chemical physics : PCCP, 2022-06, Vol.24 (21), p.1313-13148

2022

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Toward size-dependent thermodynamics of nanoparticles from quantum chemical calculations of small atomic clusters: a case study of (B 2 O 3 ) n

Physical chemistry chemical physics : PCCP, 2022-06, Vol.24 (21), p.13130-13148

2022

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Reaction of the N Atom with Electronically Excited O2 Revisited: A Theoretical Study

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2021-09, Vol.125 (37), p.8294-8312

2021

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Reactions of electronically excited molecular nitrogen with H2 and H2O molecules: theoretical study

Journal of physics. D, Applied physics, 2018-04, Vol.51 (18)

2018

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Reaction of H2 with O2 in Excited Electronic States: Reaction Pathways and Rate Constants

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2017-12, Vol.121 (50), p.9599-9611

2017

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Interaction of ethane with singlet oxygen: A theoretical study of potential energy surfaces

Journal of physics. Conference series, 2021-05, Vol.1891 (1), p.12020

2021

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Small atomic clusters: quantum chemical research of isomeric composition and physical properties

Structural chemistry, 2019-12, Vol.30 (6), p.2057-2084

2019

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The influence of vibrations of polyatomic molecules on dipole moment and static dipole polarizability: theoretical study

Journal of physics. B, Atomic, molecular, and optical physics, 2017-08, Vol.50 (16), p.165101

2017

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Reaction of H 2 with O 2 in Excited Electronic States: Reaction Pathways and Rate Constants

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2017-12, Vol.121 (50), p.9599-9611

2017

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Theoretical Study of the Reactions of Ethanol with Aluminum and Aluminum Oxide

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2015-04, Vol.119 (17), p.3897-3904

2015

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Structure and properties of (AlB2)n and (MgB2)n (n = 1, …, 10) clusters

The European physical journal. D, Atomic, molecular, and optical physics, 2019, Vol.73 (1), p.1-11, Article 14

2019

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Influence of Internal Degrees of Freedom on Electric and Related Molecular Properties

1st Edition 2022, 2021

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Influence of vibrations and rotations of diatomic molecules on their physical properties: I. Dipole moment and static dipole polarizability

Journal of physics. B, Atomic, molecular, and optical physics, 2016-06, Vol.49 (12), p.125102

2016

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Interaction of CH4 with Electronically Excited O2: Ab Initio Potential Energy Surfaces and Reaction Kinetics

Plasma chemistry and plasma processing, 2019, Vol.39 (6), p.1533-1558

2019

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Influence of vibrations and rotations of diatomic molecules on their physical properties: II. Refractive index, reactivity and diffusion coefficients

Journal of physics. B, Atomic, molecular, and optical physics, 2016-06, Vol.49 (12), p.125103

2016

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Theoretical Study of the Reaction of Ethane with Oxygen Molecules in the Ground Triplet and Singlet Delta States

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2012-08, Vol.116 (33), p.8444-8454

2012

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Quantum chemical study of the reactions of Al, AlO and AlOH with H2O2

Chemical physics, 2016-02, Vol.465-466, p.9-16

2016

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Numerical analysis of nanoaluminum combustion in steam

Combustion and flame, 2014-06, Vol.161 (6), p.1659-1667

2014

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Theoretical study of physical and thermodynamic properties of AlnNm clusters

The European physical journal. D, Atomic, molecular, and optical physics, 2016-11, Vol.70 (11), p.1-16, Article 250

2016

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Small ternary Al n B m H l clusters: DFT analysis of structure and properties

Structural chemistry, 2018-10, Vol.29 (5), p.1573-1588

2018

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Polarizability of electronically excited molecular oxygen: theory and experiment

Journal of physics. B, Atomic, molecular, and optical physics, 2019-02, Vol.52 (4), p.45101

2019

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DFT study of small aluminum and boron hydrides: isomeric composition and physical properties

Structural chemistry, 2018-02, Vol.29 (1), p.49-68

2018

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A simple semiempirical model for the static polarizability of ions

A simple semiempirical model for the static polarizability of electronically excited atoms and molecules

Molecular Collision Diameters and Electronic Polarizabilities: Inherent Relationship and Fast Evaluation

Toward size-dependent thermodynamics of nanoparticles from quantum chemical calculations of small atomic clusters: a case study of (BO)

Toward size-dependent thermodynamics of nanoparticles from quantum chemical calculations of small atomic clusters: a case study of (B 2 O 3 ) n

Reaction of the N Atom with Electronically Excited O2 Revisited: A Theoretical Study

Reactions of electronically excited molecular nitrogen with H2 and H2O molecules: theoretical study

Reaction of H2 with O2 in Excited Electronic States: Reaction Pathways and Rate Constants

Interaction of ethane with singlet oxygen: A theoretical study of potential energy surfaces

Small atomic clusters: quantum chemical research of isomeric composition and physical properties

The influence of vibrations of polyatomic molecules on dipole moment and static dipole polarizability: theoretical study

Reaction of H 2 with O 2 in Excited Electronic States: Reaction Pathways and Rate Constants

Theoretical Study of the Reactions of Ethanol with Aluminum and Aluminum Oxide

Structure and properties of (AlB2)n and (MgB2)n (n = 1, …, 10) clusters

Influence of Internal Degrees of Freedom on Electric and Related Molecular Properties

Influence of vibrations and rotations of diatomic molecules on their physical properties: I. Dipole moment and static dipole polarizability

Interaction of CH4 with Electronically Excited O2: Ab Initio Potential Energy Surfaces and Reaction Kinetics

Influence of vibrations and rotations of diatomic molecules on their physical properties: II. Refractive index, reactivity and diffusion coefficients

Theoretical Study of the Reaction of Ethane with Oxygen Molecules in the Ground Triplet and Singlet Delta States

Quantum chemical study of the reactions of Al, AlO and AlOH with H2O2

Numerical analysis of nanoaluminum combustion in steam

Theoretical study of physical and thermodynamic properties of AlnNm clusters

Small ternary Al n B m H l clusters: DFT analysis of structure and properties

Polarizability of electronically excited molecular oxygen: theory and experiment

DFT study of small aluminum and boron hydrides: isomeric composition and physical properties

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