Theoretical study of the He-HF+ complex. I. The two asymptotically degenerate ground state potential energy surfaces

Quantum mechanical calculations on weakly interacting complexes

Heijmen, T.G.A.

January 1998

Contains fulltext : 18612.pdf (publisher's version ) (Open Access)Symmetry-adapted...

Theoretical Studies of Potential Energy Surface and Bound States of the Strongly Bound He(1S)–BeO (1Σ+) Complex

Michał Hapka (1930927)
Jacek Kłos (1337355)
Tatiana Korona (1670575)
Grzegorz Chałasiński (1930930)

August 2013

We perform electronic structure calculations of the potential energy surface of the He···BeO(1...

DEVELOPMENT OF A FULL 3-DIMENSIONAL POTENTIAL ENERGY SURFACE FOR He-HF FROM HIGH-RESOLUTION SPECTROSCOPY

Slee, Tom
Le Roy, Robert J.

January 1991

Author Institution: Guelph-Waterloo Centre for Graduate Work in Chemistry, University of WaterlooAll...

Theoretical study of the He-HF+ complex. I. The two asymptotically degenerate ground state potential energy surfaces.

Lotrich, VF
Wormer, P.E.S.
Avoird, A. van der

January 2004

Contains fulltext : 60244.pdf (publisher's version ) (Open Access)Two three-dimens...

Theoretical study of the He-HF+ complex. I. The two asymptotically degenerate ground state potential energy surfaces.

Lotrich, VF
Wormer, P.E.S.
Avoird, A. van der

January 2004

Two three-dimensional potential energy surfaces (PESs) are reported for the cationic complex He-HF+;...

Near dissociation states for H2+-He on MRCI and FCI potential energy surfaces

Koner, Debasish
San Vicente Veliz, Juan Carlos
van der Avoird, Ad
Meuwly, Markus

January 2019

New potential energy surfaces (PES) have been constructed for H2+-He using a reproducing kernel Hilb...

Near-dissociation states and coupled potential curves for the HeN+ complex.

Soldán, P.
Hutson, J. M.

August 2002

The near-dissociation microwave rovibronic spectra of HeN+ [Carrington et al., Chem. Phys. Lett. 262...

Intermolecular potential energy surfaces and bound states in F–HF.

Meuwly, M.
Hutson, J.M.

January 2000

Semiempiricalpotential energy surfaces for F–HF are constructed, based on recent Ne–HF, Ne–F, and Ne...

The potential energy surface and near-dissociation states of He-H+2.

Meuwly, M.
Hutson, J.M.

February 1999

The potential energy surface for the ground state of He-H+2 is calculated using ab initio QCISD(T) c...

ISOMERS IN HELIUM COMPLEXES: OBSERVATION OF T-SHAPED AND LINEAR $He-CH_{3}F$, AND PREDICTION OF TWO NEARLY ISOENERGETIC FORMS OF $He-ClF_{3}$

Higgins, Kelly J.
Klemperer, William

January 2000

$^{a}$54th International Symposium on Molecular Spectroscopy (1999) $^{b}$52nd International Symposi...

ISOMERS IN HELIUM COMPLEXES: OBSERVATION OF T-SHAPED AND LINEAR $He-CH_{3}F$, AND PREDICTION OF TWO NEARLY ISOENERGETIC FORMS OF $He-ClF_{3}$

Higgins, Kelly J.
Klemperer, William

January 2000

$^{a}$54th International Symposium on Molecular Spectroscopy (1999) $^{b}$52nd International Symposi...

Theoretical study of the He-HF+ complex. II. Rovibronic states from coupled diabatic potential energy surfaces

Dhont, G.
Zeimen, W.B.
Groenenboom, G.C.
Avoird, A. van der

January 2004

Contains fulltext : 13867.pdf (publisher's version ) (Closed access

The intermolecular potential energy surface of the He·NO+ cationic complex

Soldán, Pavel
Lee, Edmond P.F.
Wright, Timothy G.

February 2002

Close-coupling calculations of bound rotational and vibrational states are carried out on a new inte...

Potential energy surfaces and bound states for the open-shell van der Waals cluster Br–HF.

Meuwly, M.
Hutson, J. M.

November 2003

Semiempiricalpotential energy surfaces for the lowest three electronic states of the open-shell comp...

Spectrum and vibrational predissociation of the HF dimer. I. Bound and quasibound states

Vissers, G.W.M.
Groenenboom, G.C.
Avoird, A. van der

January 2003

Contains fulltext : 13891.pdf (publisher's version ) (Open Access

Quantum mechanical calculations on weakly interacting complexes

Heijmen, T.G.A.

January 1998

Contains fulltext : 18612.pdf (publisher's version ) (Open Access)Symmetry-adapted...

Theoretical Studies of Potential Energy Surface and Bound States of the Strongly Bound He(1S)–BeO (1Σ+) Complex

Michał Hapka (1930927)
Jacek Kłos (1337355)
Tatiana Korona (1670575)
Grzegorz Chałasiński (1930930)

August 2013

We perform electronic structure calculations of the potential energy surface of the He···BeO(1...

DEVELOPMENT OF A FULL 3-DIMENSIONAL POTENTIAL ENERGY SURFACE FOR He-HF FROM HIGH-RESOLUTION SPECTROSCOPY

Slee, Tom
Le Roy, Robert J.

January 1991

Author Institution: Guelph-Waterloo Centre for Graduate Work in Chemistry, University of WaterlooAll...

Theoretical study of the He-HF+ complex. I. The two asymptotically degenerate ground state potential energy surfaces.

Lotrich, VF
Wormer, P.E.S.
Avoird, A. van der

January 2004

Contains fulltext : 60244.pdf (publisher's version ) (Open Access)Two three-dimens...

Theoretical study of the He-HF+ complex. I. The two asymptotically degenerate ground state potential energy surfaces.

Lotrich, VF
Wormer, P.E.S.
Avoird, A. van der

January 2004

Two three-dimensional potential energy surfaces (PESs) are reported for the cationic complex He-HF+;...

Near dissociation states for H2+-He on MRCI and FCI potential energy surfaces

Koner, Debasish
San Vicente Veliz, Juan Carlos
van der Avoird, Ad
Meuwly, Markus

January 2019

New potential energy surfaces (PES) have been constructed for H2+-He using a reproducing kernel Hilb...

Near-dissociation states and coupled potential curves for the HeN+ complex.

Soldán, P.
Hutson, J. M.

August 2002

The near-dissociation microwave rovibronic spectra of HeN+ [Carrington et al., Chem. Phys. Lett. 262...

Intermolecular potential energy surfaces and bound states in F–HF.

Meuwly, M.
Hutson, J.M.

January 2000

Semiempiricalpotential energy surfaces for F–HF are constructed, based on recent Ne–HF, Ne–F, and Ne...

The potential energy surface and near-dissociation states of He-H+2.

Meuwly, M.
Hutson, J.M.

February 1999

The potential energy surface for the ground state of He-H+2 is calculated using ab initio QCISD(T) c...

ISOMERS IN HELIUM COMPLEXES: OBSERVATION OF T-SHAPED AND LINEAR $He-CH_{3}F$, AND PREDICTION OF TWO NEARLY ISOENERGETIC FORMS OF $He-ClF_{3}$

Higgins, Kelly J.
Klemperer, William

January 2000

$^{a}$54th International Symposium on Molecular Spectroscopy (1999) $^{b}$52nd International Symposi...

ISOMERS IN HELIUM COMPLEXES: OBSERVATION OF T-SHAPED AND LINEAR $He-CH_{3}F$, AND PREDICTION OF TWO NEARLY ISOENERGETIC FORMS OF $He-ClF_{3}$

Higgins, Kelly J.
Klemperer, William

January 2000

$^{a}$54th International Symposium on Molecular Spectroscopy (1999) $^{b}$52nd International Symposi...

Theoretical study of the He-HF+ complex. II. Rovibronic states from coupled diabatic potential energy surfaces

Dhont, G.
Zeimen, W.B.
Groenenboom, G.C.
Avoird, A. van der

January 2004

Contains fulltext : 13867.pdf (publisher's version ) (Closed access

The intermolecular potential energy surface of the He·NO+ cationic complex

Soldán, Pavel
Lee, Edmond P.F.
Wright, Timothy G.

February 2002

Close-coupling calculations of bound rotational and vibrational states are carried out on a new inte...

Potential energy surfaces and bound states for the open-shell van der Waals cluster Br–HF.

Meuwly, M.
Hutson, J. M.

November 2003

Semiempiricalpotential energy surfaces for the lowest three electronic states of the open-shell comp...

Spectrum and vibrational predissociation of the HF dimer. I. Bound and quasibound states

Vissers, G.W.M.
Groenenboom, G.C.
Avoird, A. van der

January 2003

Contains fulltext : 13891.pdf (publisher's version ) (Open Access

Quantum mechanical calculations on weakly interacting complexes

Heijmen, T.G.A.

January 1998

Contains fulltext : 18612.pdf (publisher's version ) (Open Access)Symmetry-adapted...

Theoretical Studies of Potential Energy Surface and Bound States of the Strongly Bound He(1S)–BeO (1Σ+) Complex

Michał Hapka (1930927)
Jacek Kłos (1337355)
Tatiana Korona (1670575)
Grzegorz Chałasiński (1930930)

August 2013

We perform electronic structure calculations of the potential energy surface of the He···BeO(1...

DEVELOPMENT OF A FULL 3-DIMENSIONAL POTENTIAL ENERGY SURFACE FOR He-HF FROM HIGH-RESOLUTION SPECTROSCOPY

Slee, Tom
Le Roy, Robert J.

January 1991

Author Institution: Guelph-Waterloo Centre for Graduate Work in Chemistry, University of WaterlooAll...

Theoretical study of the He-HF+ complex. I. The two asymptotically degenerate ground state potential energy surfaces

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Theoretical study of the He-HF+ complex. I. The two asymptotically degenerate ground state potential energy surfaces

Abstract

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