van der waals dimer Recently Published Documents

Ab Initio ◽

Energy Surface ◽

Van Der Waals ◽

High Accuracy ◽

Explicitly correlated potential energy surface of the CO2–CO van der Waals dimer and applications

Physical Chemistry Chemical Physics ◽

10.1039/c9cp02657f ◽

2019 ◽

Vol 21 (28) ◽

pp. 15871-15878 ◽

Cited By ~ 1

Author(s):

Ayda Badri ◽

Leonid Shirkov ◽

Nejm-Eddine Jaidane ◽

Majdi Hochlaf

Keyword(s):

Potential Energy ◽

Ab Initio ◽

Energy Surface ◽

Van Der Waals ◽

Explicitly Correlated ◽

Using ab initio methodology, we generated the 4D-PES of the CO2–CO complex for spectroscopic and dynamical computations.

Interatomic potentials of metal dimers: probing agreement between experiment and advancedab initiocalculations for van der Waals dimer Cd2

International Reviews in Physical Chemistry ◽

10.1080/0144235x.2017.1337371 ◽

2017 ◽

Vol 36 (4) ◽

pp. 541-620 ◽

Cited By ~ 5

Author(s):

T. Urbańczyk ◽

M. Strojecki ◽

M. Krośnicki ◽

A. Kędziorski ◽

P. S. Żuchowski ◽

...

Keyword(s):

Van Der Waals ◽

Interatomic Potentials ◽

Radical Cations of the Monomer and van der Waals Dimer of a Methionine Residue as Prototypes of (2 Center–3 Electron) SN and SS Bonds. Molecular Simulations of Their Absorption Spectra in Water

The Journal of Physical Chemistry B ◽

10.1021/acs.jpcb.6b06329 ◽

2016 ◽

Vol 120 (37) ◽

pp. 9875-9886 ◽

Cited By ~ 5

Author(s):

Pierre Archirel ◽

Jacqueline Bergès ◽

Chantal Houée-Lévin

Keyword(s):

Absorption Spectra ◽

Van Der Waals ◽

Molecular Simulations ◽

Radical Cations ◽

Methionine Residue ◽

Anchoring the potential energy surface of an important atmospheric van der Waals dimer, the H2O⋯O2 complex

Computational and Theoretical Chemistry ◽

10.1016/j.comptc.2015.08.022 ◽

2015 ◽

Vol 1072 ◽

pp. 21-27 ◽

Cited By ~ 5

Author(s):

Katelyn M. Dreux ◽

Gregory S. Tschumper

Keyword(s):

Potential Energy ◽

Energy Surface ◽

Van Der Waals ◽

Interatomic potentials of the heavy van der Waals dimer Hg 2 : A “test-bed” for theory-to-experiment agreement

Physics Reports ◽

10.1016/j.physrep.2015.06.004 ◽

2015 ◽

Vol 591 ◽

pp. 1-31 ◽

Cited By ~ 6

Author(s):

M. Krośnicki ◽

M. Strojecki ◽

T. Urbańczyk ◽

A. Pashov ◽

J. Koperski

Keyword(s):

Van Der Waals ◽

Interatomic Potentials ◽

Test Bed ◽

Theoretical studies of the N2O van der Waals dimer: Ab initio potential energy surface, intermolecular vibrations and rotational transition frequencies

The Journal of Chemical Physics ◽

10.1063/1.3523984 ◽

2011 ◽

Vol 134 (5) ◽

pp. 054311 ◽

Cited By ~ 18

Author(s):

Limin Zheng ◽

Yunpeng Lu ◽

Soo-Ying Lee ◽

Hong Fu ◽

Minghui Yang

Keyword(s):

Potential Energy ◽

Ab Initio ◽

Energy Surface ◽

Van Der Waals ◽

Rotational Transition ◽

Theoretical Studies ◽

Intermolecular Vibrations ◽

High resolution overtone spectroscopy of the acetylene van der Waals dimer, (12C2H2)2

Physical Chemistry Chemical Physics ◽

10.1039/c1cp20561g ◽

2011 ◽

Vol 13 (31) ◽

pp. 14010 ◽

Cited By ~ 18

Author(s):

K. Didriche ◽

C. Lauzin ◽

T. Földes ◽

D. Golebiowski ◽

M. Herman ◽

...

Keyword(s):

High Resolution ◽

Van Der Waals ◽

Overtone Spectroscopy ◽

ChemInform Abstract: Pump-Probe Fluorescence Studies of Excimer Formation and Dissociation for the van der Waals Dimer of Fluorene.

ChemInform ◽

10.1002/chin.199125045 ◽

2010 ◽

Vol 22 (25) ◽

pp. no-no

Author(s):

H. SAIGUSA ◽

E. C. LIM

Keyword(s):

Van Der Waals ◽

Pump Probe ◽

Fluorescence Studies ◽

Excimer Formation ◽

Photodissociation of (ICN)2 van der Waals dimer using velocity imaging technique

The Journal of Chemical Physics ◽

10.1063/1.3148376 ◽

2009 ◽

Vol 130 (21) ◽

pp. 214305 ◽

Cited By ~ 7

Author(s):

Xiao-peng Zhang ◽

Wei-Bin Lee ◽

Dong-feng Zhao ◽

Ming-Kai Hsiao ◽

Yu-Ling Chen ◽

...

Keyword(s):

Imaging Technique ◽

Van Der Waals ◽

Velocity Imaging ◽