V. Pupyshev

发表

Molecular mechanism of hydrogen bromide addition to olefins

L. A. Tyurina, G. Sergeev, V. Smirnov, 1982 .

SOME ASPECTS OF SCALING THE MOLECULAR QUANTUM MECHANICAL FORCE FIELD

N. F. Stepanov, Y. Panchenko, G. D. Maré, 1996 .

Harmonic force field: An approximate relationship between the exact nonrelativistic and the Hartree-Fock limit values of the force constants

Charles W. Bock, Vladimir I. Pupyshev, C. Bock, 1991 .

Structure and dynamics of acrolein in (1,3)(pi,pi*) excited electronic states: a quantum-chemical study.

O. Bokareva, V. Bataev, I. Godunov, 2009, Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy.

Reinterpretation of the fluorescence excitation spectrum of hexafluorobiacetyl in a supersonic jet

I. Godunov, A. Abramenkov, V. Pupyshev, 1997 .

Hidden symmetry in the confined hydrogen atom problem

A. V. Scherbinin, V. I. Pupyshev, V. Pupyshev, 2002 .

One-dimensional models of internal rotation in CX3NO molecules (X = H, D, F)

V. Bataev, I. Godunov, E. K. Dolgov, 2005 .

Exact Relations for Confined One-Electron Systems

K. Sen, H. Montgomery, V. I. Pupyshev, 2009 .

States of a hydrogen atom in an impenetrable cubic cavity

A. V. Scherbinin, V. I. Pupyshev, M. Kretov, 2009 .

Symmetry Reduction and Energy Levels Splitting of the One-Electron Atom in an Impenetrable Cavity

A. V. Scherbinin, V. I. Pupyshev, V. Pupyshev, 2014 .

How to spoil a good basis set for Rayleigh-Ritz calculations

H. Montgomery, V. Pupyshev, 2013 .

Hellmann–Feynman theorem near the threshold

V. Pupyshev, 2002 .

ON THE USE OF MULTIPOLE EXPANSION OF THE COULOMB POTENTIAL IN QUANTUM CHEMISTRY

N. F. Stepanov, A. V. Scherbinin, V. Pupyshev, 1996 .

Analytic properties of solution of electronic Schrödinger equation

P. Ganelin, V. Pupyshev, 1991 .

Ab initio description of the structure and dynamics of the nitrosomethane molecule in the first excited singlet and triplet electronic states

V. Bataev, I. Godunov, E. K. Dolgov, 2004 .

Vibronic spectra, ab initio calculations, and structures of conformationally non-rigid molecules of oxalyl halides in the ground and lowest excited electronic states. Part II: Theoretical investigation of oxalyl chloride

S. I. Bokarev, I. Godunov, V. I. Pupyshev, 2009 .

VIBRATIONAL ANHARMONICITY AND SCALING THE QUANTUM MECHANICAL MOLECULAR FORCE FIELD

C. Bock, Y. Panchenko, V. I. Pupyshev, 2000 .

Nonadiabatic corrections in nonempirical calculations of molecular oscillation frequencies

Y. Panchenko, V. I. Pupyshev, V. Pupyshev, 1991 .

Structure and conformational dynamics of the dicyclopropyl ketone in the ground electronic state

V. Bataev, I. Godunov, V. I. Pupyshev, 2010 .

Effect of basic set quality and electron correlation on the scale factors of a harmonic force field

C. Bock, Y. Panchenko, V. I. Pupyshev, 1990 .

On lower bounds for polarisability

V. I. Pupyshev, H. Montgomery, V. Pupyshev, 2013 .

On lower bounds for polarisability

H. Montgomery, V. I. Pupyshev, V. Pupyshev, 2013, The European Physical Journal H.

Confined helium: Excited singlet and triplet states

H. Montgomery, V. I. Pupyshev, V. Pupyshev, 2013 .

Spherically symmetric states of Hookium in a cavity

H. Montgomery, V. I. Pupyshev, V. Pupyshev, 2015 .

Perturbation theory for the hydrogen atom in a spherical cavity with off-centre nucleus

M. E. Changa, A. V. Scherbinin, V. I. Pupyshev, 2000 .

Confined two-electron systems: excited singlet and triplet S states

V. I. Pupyshev, Vladimir I. Pupyshev, H. Montgomery, 2014, Theoretical Chemistry Accounts.

Normal ordering of the su(1, 1) ladder operators for the quasi-number states of the Morse oscillator

S. V. Krasnoshchekov, Xuanhao Chang, V. I. Pupyshev, 2020 .

The I2(B) predissociation by solving an inverse atoms-in-molecule problem

N. F. Stepanov, A. Buchachenko, S. Umanskii, 2001 .

Testing the Validity of Scaling the Quantum Mechanical Molecular Force Fields for Rotational Isomers

Y. Panchenko, V. Pupyshev, and George R. De Maré, 1995 .