Multi-component molecular orbital study on positron attachment to alkali-metal hydride molecules: nature of chemical bonding and dissociation limits of [LiH; e+]

The European Physical Journal D ◽

10.1140/epjd/e2014-40708-4 ◽

2014 ◽

Vol 68 (8) ◽

Author(s):

Takayuki Oyamada ◽

Masanori Tachikawa

Keyword(s):

Alkali Metal ◽

Molecular Orbital ◽

Metal Hydride ◽

Chemical Bonding ◽

Molecular Orbital Study ◽

Orbital Study ◽

Alkali Metal Hydride

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Diastereomeric Δ-1,4,7,10-Tetrakis((R)-2-hydroxy-2-phenylethyl)- 1,4,7,10-tetraazacyclododecane and Its Alkali-Metal Complex Ions. A Potentiometric Titration, Nuclear Magnetic Resonance, and Molecular Orbital Study

Journal of the American Chemical Society ◽

10.1021/ja973367l ◽

1998 ◽

Vol 120 (12) ◽

pp. 2862-2869 ◽

Author(s):

Sonya L. Whitbread ◽

Peter Valente ◽

Mark A. Buntine ◽

Philip Clements ◽

Stephen F. Lincoln ◽

...

Keyword(s):

Nuclear Magnetic Resonance ◽

Magnetic Resonance ◽

Alkali Metal ◽

Metal Complex ◽

Potentiometric Titration ◽

Molecular Orbital ◽

Complex Ions ◽

Molecular Orbital Study ◽

Orbital Study ◽

Alkali Metal Complex

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Localized molecular orbital study on chemical bonding and reactivities of certain Mo-Cu-S cluster compounds

Journal of Cluster Science ◽

10.1007/bf01170714 ◽

1994 ◽

Vol 5 (2) ◽

pp. 303-315 ◽

Author(s):

Zhida Chen ◽

Chunwan Liu ◽

Jaixi Lu

Keyword(s):

Molecular Orbital ◽

Chemical Bonding ◽

Cluster Compounds ◽

Molecular Orbital Study ◽

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Diastereomeric 1,4,7,10-Tetrakis((S)-2-hydroxypropyl)- 1,4,7,10-tetraazacyclododecane and Its Alkali Metal Complex Ions. A Nuclear Magnetic Resonance, Potentiometric Titration, and Molecular Orbital Study

Journal of the American Chemical Society ◽

10.1021/ja9702071 ◽

1997 ◽

Vol 119 (26) ◽

pp. 6126-6134 ◽

Author(s):

Ramesh S. Dhillon ◽

Samer E. Madbak ◽

Frank G. Ciccone ◽

Mark A. Buntine ◽

Stephen F. Lincoln ◽

...

Keyword(s):

Nuclear Magnetic Resonance ◽

Magnetic Resonance ◽

Alkali Metal ◽

Metal Complex ◽

Potentiometric Titration ◽

Molecular Orbital ◽

Complex Ions ◽

Molecular Orbital Study ◽

Orbital Study ◽

Alkali Metal Complex

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Anisole as an Ambidentate Ligand: Ab Initio Molecular Orbital Study of Alkali Metal Cations Binding to Anisole

The Journal of Physical Chemistry A ◽

10.1021/jp990570p ◽

1999 ◽

Vol 103 (48) ◽

pp. 9815-9820 ◽

Author(s):

John B. Nicholas ◽

Benjamin P. Hay

Keyword(s):

Alkali Metal ◽

Ab Initio ◽

Molecular Orbital ◽

Metal Cations ◽

Alkali Metal Cations ◽

Molecular Orbital Study ◽

Orbital Study ◽

Ambidentate Ligand

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Ab Initio Molecular Orbital Study of Cation−π Binding between the Alkali-Metal Cations and Benzene

The Journal of Physical Chemistry A ◽

10.1021/jp9837380 ◽

1999 ◽

Vol 103 (10) ◽

pp. 1394-1400 ◽

Author(s):

John B. Nicholas ◽

Benjamin P. Hay ◽

David A. Dixon

Keyword(s):

Alkali Metal ◽

Ab Initio ◽

Molecular Orbital ◽

Metal Cations ◽

Alkali Metal Cations ◽

Molecular Orbital Study ◽

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Changes in the structure of alkali-metal silicate glasses with the type of network modifier cation: an ab initio molecular orbital study

The Journal of Physical Chemistry ◽

10.1021/j100185a013 ◽

1992 ◽

Vol 96 (6) ◽

pp. 2455-2463 ◽

Author(s):

Takashi Uchino ◽

Tetsuo Sakka ◽

Yukio Ogata ◽

Matae Iwasaki

Keyword(s):

Alkali Metal ◽

Ab Initio ◽

Molecular Orbital ◽

Silicate Glasses ◽

Network Modifier ◽

Molecular Orbital Study ◽

Orbital Study ◽

Metal Silicate ◽

Modifier Cation

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ChemInform Abstract: SEMI-EMPIRICAL MOLECULAR ORBITAL STUDY OF THE DIBORONTETRAHYDRIDE MOLECULE

Chemischer Informationsdienst ◽

10.1002/chin.197817007 ◽

1978 ◽

Vol 9 (17) ◽

Author(s):

M. K. DATTA ◽

R. DATTA

Keyword(s):

Molecular Orbital ◽

Molecular Orbital Study ◽

Orbital Study ◽

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ChemInform Abstract: MOLECULAR ORBITAL STUDY OF SUBSTITUTED TRIMETHYLENEMETHANE-BIS(PHOSPHINE)PALLADIUM COMPLEXES

Chemischer Informationsdienst ◽

10.1002/chin.198201084 ◽

1982 ◽

Vol 13 (1) ◽

Author(s):

D. J. GORDON ◽

R. F. FENSKE ◽

T. N. NANNINGA ◽

B. M. TROST

Keyword(s):

Molecular Orbital ◽

Palladium Complexes ◽

Molecular Orbital Study ◽

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Molecular Orbital Study on Quartet Molecules with Trigonal Axis of Symmetry

Molecular Crystals and Liquid Crystals Science and Technology Section A Molecular Crystals and Liquid Crystals ◽

10.1080/10587259308035722 ◽

1993 ◽

Vol 232 (1) ◽

pp. 323-332 ◽

Author(s):

Kazunari Yoshizawa ◽

Masashi Hatanaka ◽

Akihiro Ito ◽

Kazuyoshi Tanaka ◽

Tokio Yamabe

Keyword(s):

Molecular Orbital ◽

Trigonal Axis ◽

Molecular Orbital Study ◽

Orbital Study ◽

Axis Of Symmetry

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ChemInform Abstract: AN AB INITIO MOLECULAR ORBITAL STUDY OF STRUCTURES AND ENERGIES OF SPIRO COMPOUNDS- SPIROPENTANE, SPIROPENTENE, SPIROPENTADIENE, SPIRO(2.4)HEPTA-4,6-DIENE, SPIRO(2.4)HEPTATRIENE, AND SPIRO(4.4)NONATETRAENE

Chemischer Informationsdienst ◽

10.1002/chin.197820069 ◽

1978 ◽

Vol 9 (20) ◽

Author(s):

J. KAO ◽

L. RADOM

Keyword(s):

Ab Initio ◽

Molecular Orbital ◽

Spiro Compounds ◽

Molecular Orbital Study ◽

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