4.7 Article

The structure and binding energies of the van der Waals complexes of Ar and N2 with phenol and its cation, studied by high level ab initio and density functional theory calculations

相关参考文献

注意:仅列出部分参考文献,下载原文获取全部文献信息。
Article Chemistry, Physical

IR signature of the photoionization-induced hydrophobic→hydrophilic site switching in phenol-Arn clusters

Shun-ichi Ishiuchi et al.

JOURNAL OF CHEMICAL PHYSICS (2007)

Article Chemistry, Physical

Hole-burning spectra of Phenol-Arn (n=1,2) clusters:: Resolution of the isomer issue

Shun-Ichi Ishiuchi et al.

JOURNAL OF PHYSICAL CHEMISTRY A (2007)

Article Chemistry, Physical

Can the DFT-D method describe the full range of noncovalent interactions found in large biomolecules?

Claudio Morgado et al.

PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2007)

Article Chemistry, Multidisciplinary

Popular theoretical methods predict benzene and arenes to be nonplanar

Damian Moran et al.

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2006)

Article Chemistry, Physical

Assessment of model chemistries for noncovalent interactions

Yan Zhao et al.

JOURNAL OF CHEMICAL THEORY AND COMPUTATION (2006)

Article Chemistry, Physical

Franck-Condon simulations of clusters:: Phenol-nitrogen

I Pugliesi et al.

JOURNAL OF PHYSICAL CHEMISTRY A (2006)

Review Chemistry, Multidisciplinary

The world of non-covalent interactions: 2006

P Hobza et al.

COLLECTION OF CZECHOSLOVAK CHEMICAL COMMUNICATIONS (2006)

Article Chemistry, Physical

Theoretical study of neutral and cationic complexes involving phenol

F Tran et al.

INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY (2005)

Article Chemistry, Physical

How well can new-generation density functional methods describe stacking interactions in biological systems?

Y Zhao et al.

PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2005)

Article Chemistry, Physical

The structure of the phenol-nitrogen cluster:: A joint experimental and ab initio study

M Schmitt et al.

JOURNAL OF CHEMICAL PHYSICS (2004)

Article Chemistry, Multidisciplinary

Accurate description of van der Waals complexes by density functional theory including empirical corrections

S Grimme

JOURNAL OF COMPUTATIONAL CHEMISTRY (2004)

Article Chemistry, Physical

Infrared spectra of the H-bound and π-bound isomers of the phenol-argon cation

N Solcà et al.

JOURNAL OF MOLECULAR STRUCTURE (2001)

Article Spectroscopy

Is the phenol•Ar complex van der Waals or hydrogen-bonded?: A REMPI and ZEKE spectroscopic study

SR Haines et al.

JOURNAL OF ELECTRON SPECTROSCOPY AND RELATED PHENOMENA (2000)