Ab initio potential energy surfaces of Ar-NH3 for different NH3 umbrella angles

Potential energy surface and bound states of the NH$_3$–Ar and ND$_3$–Ar complexes

Loreau, Jérôme
Liévin, Jacques
Scribano, Yohann
van Der Avoird, A.

January 2014

International audienceA new, four-dimensional potential energy surface for the interaction of NH3 an...

Potential energy surface and bound states of the NH$_3$–Ar and ND$_3$–Ar complexes

Loreau, Jérôme
Liévin, Jacques
Scribano, Yohann
van Der Avoird, A.

January 2014

International audienceA new, four-dimensional potential energy surface for the interaction of NH3 an...

Potential energy surface and bound states of the NH$_3$–Ar and ND$_3$–Ar complexes

Loreau, Jérôme
Liévin, Jacques
SCRIBANO, Yohann
van der Avoird, A.

January 2014

International audienceA new, four-dimensional potential energy surface for the interaction of NH3 an...

Ab initio potential energy surfaces of Ar-H2O and Ar-D2O

Bulski, M.
Wormer, P.E.S.
Avoird, A. van der

January 1991

Contains fulltext : 6874.pdf (publisher's version ) (Open Access

Publisher's note: Ab initio potential energy surfaces for NH((3)Sigma(-))-NH((3)Sigma(-)) with analytical long range (vol 131, 224314, 2009)

Janssen, L.M.C.
Groenenboom, G.C.
Avoird, A. van der
Zuchowski, P.S.
Podeszwa, R.

January 2010

Contains fulltext : 84165.pdf (publisher's version ) (Open Access)1 p

Ab initio calculation of NH3 spectrum

Polyansky, Oleg

June 2016

An {\it ab initio} potential energy surface (PES) for NH$_3$ is computed using the methodology pione...

The Potential Energy Surface and Equilibrium Geometry of Ar··PH3

Latajka, Z.
Scheiner, Steve

July 1989

The potential energy surface of the complex formed between Ar and PH3 is investigated by ab initio m...

The Potential Energy Surface and Equilibrium Geometry of Ar··PH3

Latajka, Z.
Scheiner, Steve

July 1989

The potential energy surface of the complex formed between Ar and PH3 is investigated by ab initio m...

Ab initio calculation of NH3 spectrum

Polyansky, Oleg

June 2016

An {\it ab initio} potential energy surface (PES) for NH$_3$ is computed using the methodology pione...

Potential energy surface and bound states of the NH3-Ar and ND3-Ar complexes

Loreau, Jérôme
Liévin, Jacques
Scribano, Y.
Van der Avoird, Ad

January 2014

A new, four-dimensional potential energy surface for the interaction of NH3 and ND3 with Ar is compu...

Ab initio potential-energy surface and rotationally inelastic integral cross sections of the Ar-CH4 complex

Heijmen, T.G.A.
Korona, T.
Moszynski, R.
Wormer, P.E.S.
Avoird, A. van der

January 1997

Contains fulltext : 6818.pdf (publisher's version ) (Open Access

Global Analytical Potential Energy Surface for the Electronic Ground State of NH<sub>3</sub> from High Level ab Initio Calculations

Marquardt, R.
Sagui, K.
Zheng, J.
Thiel, W.
Luckhaus, D.
Yurchenko, S.
Mariotti, F.
Quack, M.

August 2013

The analytical, full-dimensional, and global representation of the potential energy surface of NH3 i...

Ab initio study of the O-3-N-2 complex: Potential energy surface and rovibrational states

Kalugina, Y.N.
Egorov, Oleg
Avoird, A. van der

January 2021

Contains fulltext : 239019.pdf (Publisher’s version ) (Closed access

Vibrational energies for NH3 based on high level ab initio potential energy surfaces

Lin, H.
Thiel, W.
Yurchenko, S. N.
Carvajal, M.
Jensen, P.

January 2002

Ab initio coupled cluster calculations with single and double substitutions and a perturbative treat...

ACCURATE AB INITIO POTENTIAL SURFACES OK AR-HF, $AR-H_{2}O$, AND $AR-NH_{3}$

Tao, Fu-Ming
Klemperer, William

January 1994

1. J.M. Hutson, J. Chem, Phys 96, 6752 (1992). 2. R.C. Cohen and R.J. Saykally, J. Chem. Phys, 98, 1...

Potential energy surface and bound states of the NH$_3$–Ar and ND$_3$–Ar complexes

Loreau, Jérôme
Liévin, Jacques
Scribano, Yohann
van Der Avoird, A.

January 2014

International audienceA new, four-dimensional potential energy surface for the interaction of NH3 an...

Potential energy surface and bound states of the NH$_3$–Ar and ND$_3$–Ar complexes

Loreau, Jérôme
Liévin, Jacques
Scribano, Yohann
van Der Avoird, A.

January 2014

International audienceA new, four-dimensional potential energy surface for the interaction of NH3 an...

Potential energy surface and bound states of the NH$_3$–Ar and ND$_3$–Ar complexes

Loreau, Jérôme
Liévin, Jacques
SCRIBANO, Yohann
van der Avoird, A.

January 2014

International audienceA new, four-dimensional potential energy surface for the interaction of NH3 an...

Ab initio potential energy surfaces of Ar-H2O and Ar-D2O

Bulski, M.
Wormer, P.E.S.
Avoird, A. van der

January 1991

Contains fulltext : 6874.pdf (publisher's version ) (Open Access

Publisher's note: Ab initio potential energy surfaces for NH((3)Sigma(-))-NH((3)Sigma(-)) with analytical long range (vol 131, 224314, 2009)

Janssen, L.M.C.
Groenenboom, G.C.
Avoird, A. van der
Zuchowski, P.S.
Podeszwa, R.

January 2010

Contains fulltext : 84165.pdf (publisher's version ) (Open Access)1 p

Ab initio calculation of NH3 spectrum

Polyansky, Oleg

June 2016

An {\it ab initio} potential energy surface (PES) for NH$_3$ is computed using the methodology pione...

The Potential Energy Surface and Equilibrium Geometry of Ar··PH3

Latajka, Z.
Scheiner, Steve

July 1989

The potential energy surface of the complex formed between Ar and PH3 is investigated by ab initio m...

The Potential Energy Surface and Equilibrium Geometry of Ar··PH3

Latajka, Z.
Scheiner, Steve

July 1989

The potential energy surface of the complex formed between Ar and PH3 is investigated by ab initio m...

Ab initio calculation of NH3 spectrum

Polyansky, Oleg

June 2016

An {\it ab initio} potential energy surface (PES) for NH$_3$ is computed using the methodology pione...

Potential energy surface and bound states of the NH3-Ar and ND3-Ar complexes

Loreau, Jérôme
Liévin, Jacques
Scribano, Y.
Van der Avoird, Ad

January 2014

A new, four-dimensional potential energy surface for the interaction of NH3 and ND3 with Ar is compu...

Ab initio potential-energy surface and rotationally inelastic integral cross sections of the Ar-CH4 complex

Heijmen, T.G.A.
Korona, T.
Moszynski, R.
Wormer, P.E.S.
Avoird, A. van der

January 1997

Contains fulltext : 6818.pdf (publisher's version ) (Open Access

Global Analytical Potential Energy Surface for the Electronic Ground State of NH<sub>3</sub> from High Level ab Initio Calculations

Marquardt, R.
Sagui, K.
Zheng, J.
Thiel, W.
Luckhaus, D.
Yurchenko, S.
Mariotti, F.
Quack, M.

August 2013

The analytical, full-dimensional, and global representation of the potential energy surface of NH3 i...

Ab initio study of the O-3-N-2 complex: Potential energy surface and rovibrational states

Kalugina, Y.N.
Egorov, Oleg
Avoird, A. van der

January 2021

Contains fulltext : 239019.pdf (Publisher’s version ) (Closed access

Vibrational energies for NH3 based on high level ab initio potential energy surfaces

Lin, H.
Thiel, W.
Yurchenko, S. N.
Carvajal, M.
Jensen, P.

January 2002

Ab initio coupled cluster calculations with single and double substitutions and a perturbative treat...

ACCURATE AB INITIO POTENTIAL SURFACES OK AR-HF, $AR-H_{2}O$, AND $AR-NH_{3}$

Tao, Fu-Ming
Klemperer, William

January 1994

1. J.M. Hutson, J. Chem, Phys 96, 6752 (1992). 2. R.C. Cohen and R.J. Saykally, J. Chem. Phys, 98, 1...

Potential energy surface and bound states of the NH$_3$–Ar and ND$_3$–Ar complexes

Loreau, Jérôme
Liévin, Jacques
Scribano, Yohann
van Der Avoird, A.

January 2014

International audienceA new, four-dimensional potential energy surface for the interaction of NH3 an...

Potential energy surface and bound states of the NH$_3$–Ar and ND$_3$–Ar complexes

Loreau, Jérôme
Liévin, Jacques
Scribano, Yohann
van Der Avoird, A.

January 2014

International audienceA new, four-dimensional potential energy surface for the interaction of NH3 an...

Potential energy surface and bound states of the NH$_3$–Ar and ND$_3$–Ar complexes

Loreau, Jérôme
Liévin, Jacques
SCRIBANO, Yohann
van der Avoird, A.

January 2014

International audienceA new, four-dimensional potential energy surface for the interaction of NH3 an...

Ab initio potential energy surfaces of Ar-NH3 for different NH3 umbrella angles

Abstract

Extracted data

Ab initio potential energy surfaces of Ar-NH3 for different NH3 umbrella angles

Abstract

Extracted data

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