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Possibilities of Distributive Gaussian sp-Functions for Calculating the Correlation Energy of Molecules in the Ground and Excited States

Optics and spectroscopy, 2021-02, Vol.129 (2), p.163-169

Glushkov, V. N.

2021

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Parametrisation of the optimised effective potential method based on the Coulson-Fischer wave function for excited states

Molecular physics, 2020-07, Vol.118 (14), p.e1696479

2020

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Electronic transition dipole moments from orthogonality constrained Hartree-Fock wavefunctions

Journal of physics. B, Atomic, molecular, and optical physics, 2017-06, Vol.50 (12), p.125101

2017

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Orthogonality-constrained Hartree–Fock and perturbation theory for high-spin open-shell excited states

Theoretical chemistry accounts, 2016, Vol.135 (1), Article 3

2016

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On the orthogonality of states with approximate wavefunctions

Journal of molecular modeling, 2019-06, Vol.25 (6), p.148-8, Article 148

2019

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Hylleraas’ variational method with orthogonality restrictions

Journal of molecular modeling, 2019-11, Vol.25 (11), p.1-8, Article 323

2019

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Distributed Gaussian basis sets: a comparison with finite difference Hartree–Fock calculations for potential energy curves of H2, LiH and BH

Journal of physics. B, Atomic, molecular, and optical physics, 2008-10, Vol.41 (20), p.205102-205102 (11)

2008

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Excited and core-ionized state calculations with a local potential expressed in terms of the external potential

International journal of quantum chemistry, 2013-03, Vol.113 (5), p.637-642

Glushkov, V. N.

2013

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On orthogonality constrained multiple core-hole states and optimized effective potential method

Journal of computational chemistry, 2012-10, Vol.33 (26), p.2058-2066

2012

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Doubly, triply, and multiply excited states from a constrained optimized effective potential method

The Journal of chemical physics, 2010-05, Vol.132 (20), p.204106-204106-6

2010

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Parameterized Effective Potential for Excited States and Its Application to the Calculation of Transition Dipole Moments

Optics and spectroscopy, 2020-04, Vol.128 (4), p.437-442

2020

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Optimized effective potential method for individual low-lying excited states

The Journal of chemical physics, 2007-05, Vol.126 (17), p.174106-174106-8

2007

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On the Choice of a Distributed Basis Set in Calculations of Transition-Dipole Moments in the One-Determinant Approximation

Optics and spectroscopy, 2018-06, Vol.124 (6), p.768-773

2018

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Alternative techniques in open-shell SCF theory

International journal of quantum chemistry, 2004-09, Vol.99 (4), p.236-246

Glushkov, V. N.

2004

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On the Coulson-Fischer wave function and a local static correlation potential

Molecular physics, 2012-02, Vol.110 (3), p.149-161

2012

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Spin-unrestricted formalism for a partially restricted Hartree-Fock approach

Journal of mathematical chemistry, 2002, Vol.31 (1), p.91-103

GLUSHKOV, V. N

2002

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Distributed Gaussian basis sets: a comparison with finite difference Hartree–Fock calculations for potential energy curves of H 2 , LiH and BH

Journal of physics. B, Atomic, molecular, and optical physics, 2008-10, Vol.41 (20), p.205102

2008

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Application of the subspace density functional theory to the excitation energies of molecules

Journal of physics. B, Atomic, molecular, and optical physics, 2002-05, Vol.35 (10), p.2313-2324, Article 310

2002

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On the energies of low-lying excited electronic states of molecules

Proceedings of the Royal Society. A, Mathematical, physical, and engineering sciences, 2001-07, Vol.457 (2011), p.1657-1674

2001

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Dissociation energies for small molecules from symmetry projected Hartree Fock states

Journal of physics. Conference series, 2010-03, Vol.213 (1), p.012030

2010

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Orthogonality of determinant functions in the Hartree-Fock method for highly excited electronic states

Optics and spectroscopy, 2015-07, Vol.119 (1), p.1-6

Glushkov, V. N.

2015

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The Coulson–Fischer wave functions for the ground and excited states of H 2 and HeH + : parametrisation using distributed Gaussian basis sets

Molecular physics, 2014-12, Vol.112 (23), p.3092-3107

2014

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The Coulson-Fischer wave functions for the ground and excited states of H sub(2) and HeH super(+): parametrisation using distributed Gaussian basis sets

Molecular physics, 2014-12, Vol.112 (23), p.3092-3107

2014

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On the Coulson-Fischer wave function for the X super(1)A' H super(+) sub(3) molecular ion: parametrisation using distributed Gaussian basis sets

Molecular physics, 2014-04, Vol.112 (7), p.904-918

2014

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The Single-Determinant Approximation with a Local Potential for Excited States

Optics and spectroscopy, 2005-11, Vol.99 (5), p.684

Glushkov, V. N.

2005

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Possibilities of Distributive Gaussian sp-Functions for Calculating the Correlation Energy of Molecules in the Ground and Excited States

Parametrisation of the optimised effective potential method based on the Coulson-Fischer wave function for excited states

Electronic transition dipole moments from orthogonality constrained Hartree-Fock wavefunctions

Orthogonality-constrained Hartree–Fock and perturbation theory for high-spin open-shell excited states

On the orthogonality of states with approximate wavefunctions

Hylleraas’ variational method with orthogonality restrictions

Distributed Gaussian basis sets: a comparison with finite difference Hartree–Fock calculations for potential energy curves of H2, LiH and BH

Excited and core-ionized state calculations with a local potential expressed in terms of the external potential

On orthogonality constrained multiple core-hole states and optimized effective potential method

Doubly, triply, and multiply excited states from a constrained optimized effective potential method

Parameterized Effective Potential for Excited States and Its Application to the Calculation of Transition Dipole Moments

Optimized effective potential method for individual low-lying excited states

On the Choice of a Distributed Basis Set in Calculations of Transition-Dipole Moments in the One-Determinant Approximation

Alternative techniques in open-shell SCF theory

On the Coulson-Fischer wave function and a local static correlation potential

Spin-unrestricted formalism for a partially restricted Hartree-Fock approach

Distributed Gaussian basis sets: a comparison with finite difference Hartree–Fock calculations for potential energy curves of H 2 , LiH and BH

Application of the subspace density functional theory to the excitation energies of molecules

On the energies of low-lying excited electronic states of molecules

Dissociation energies for small molecules from symmetry projected Hartree Fock states

Orthogonality of determinant functions in the Hartree-Fock method for highly excited electronic states

The Coulson–Fischer wave functions for the ground and excited states of H 2 and HeH + : parametrisation using distributed Gaussian basis sets

The Coulson-Fischer wave functions for the ground and excited states of H sub(2) and HeH super(+): parametrisation using distributed Gaussian basis sets

On the Coulson-Fischer wave function for the X super(1)A' H super(+) sub(3) molecular ion: parametrisation using distributed Gaussian basis sets

The Single-Determinant Approximation with a Local Potential for Excited States

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