Theoretical investigation of molecular and electronic structure changes of the molecular magnet Mn12
 cluster upon super-reduction

Molecular Magnet ◽

Structure Changes ◽

Back Cover: Theoretical investigation of molecular and electronic structure changes of the molecular magnet Mn12 cluster upon super-reduction (Phys. Status Solidi RRL 6/2014)

physica status solidi (RRL) - Rapid Research Letters ◽

10.1002/pssr.201470533 ◽

2014 ◽

Vol 8 (6) ◽

Author(s):

Yoshio Nishimoto ◽

Hirofumi Yoshikawa ◽

Kunio Awaga ◽

Marcus Lundberg ◽

Stephan Irle

Keyword(s):

Electronic Structure ◽

Molecular Magnet ◽

Back Cover ◽

Structure Changes ◽

Theoretical Investigation of Correlations Between Molecular and Electronic Structure and Antifungal Activity in Coumarin Derivatives: Combining Qsar and Dft Studies

Journal of Advances in Medical and Pharmaceutical Sciences ◽

10.9734/jamps/2018/22801 ◽

2018 ◽

Vol 16 (3) ◽

pp. 1-18

Author(s):

Abduljelil Ajala ◽

Adamu Uzairu ◽

Idris Suleiman ◽

Ahmed Uttu

Keyword(s):

Electronic Structure ◽

Antifungal Activity ◽

Coumarin Derivatives ◽

Dft Studies ◽

Experimental and Theoretical Investigation of the Molecular and Electronic Structure of [Zn4(μ4-S){μ-S2As(CH3)2}6] and [Cd4(μ4-S){μ-S2As(CH3)2}6]: Two Possible Molecular Models of Extended Metal Chalcogenide Semiconductors†

Inorganic Chemistry ◽

10.1021/ic980914a ◽

1999 ◽

Vol 38 (6) ◽

pp. 1145-1152 ◽

Cited By ~ 11

Author(s):

Alberto Albinati ◽

Maurizio Casarin ◽

Chiara Maccato ◽

Luciano Pandolfo ◽

Andrea Vittadini

Keyword(s):

Electronic Structure ◽

Molecular Models ◽

Metal Chalcogenide ◽

Chalcogenide Semiconductors ◽

Molecular and electronic structure of nonradical homoleptic pyridyl-azo-oxime complexes of cobalt(iii) and the azo-oxime anion radical congener: an experimental and theoretical investigation

Dalton Transactions ◽

10.1039/c3dt53460j ◽

2014 ◽

Vol 43 (14) ◽

pp. 5317-5334 ◽

Cited By ~ 10

Author(s):

Shuvam Pramanik ◽

Sima Roy ◽

Tapas Ghorui ◽

Sanjib Ganguly ◽

Kausikisankar Pramanik

Keyword(s):

Electronic Structure ◽

Anion Radical ◽

Synthesis and optoelectronic study of Co(iii)–pyridyl-azo-oxime complexes and isolation of Co(iii)-bound azo-oxime anion radical.

Experimental and theoretical investigation of the molecular and electronic structure of N ′-benzylidene-N -[4-(3-methyl-3-phenyl-cyclobutyl)-thiazol-2-yl]-chloro-acetic acid hydrazide

International Journal of Quantum Chemistry ◽

10.1002/qua.23086 ◽

2011 ◽

Vol 112 (4) ◽

pp. 1016-1028 ◽

Cited By ~ 4

Author(s):

Sibel Demir ◽

Muharrem Dinçer ◽

Alaaddin Çukurovali ◽

ibrahim Yilmaz

Keyword(s):

Acetic Acid ◽

Electronic Structure ◽

Acid Hydrazide ◽

The molecular and electronic structure ofs‐tetrazine in the ground and first excited state: A theoretical investigation

The Journal of Chemical Physics ◽

10.1063/1.470332 ◽

1995 ◽

Vol 103 (16) ◽

pp. 7048-7057 ◽

Cited By ~ 24

Author(s):

Martin Schütz ◽

Jürg Hutter ◽

Hans Peter Lüthi

Keyword(s):

Electronic Structure ◽

Excited State ◽

First Excited State ◽

Experimental and theoretical investigation of the molecular and electronic structure of 3-ethoxy-4-isopropylaminocyclobut-3-ene-1,2-dione

Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy ◽

10.1016/j.saa.2012.04.083 ◽

2012 ◽

Vol 96 ◽

pp. 35-41 ◽

Cited By ~ 10

Author(s):

Nevin Süleymanoğlu ◽

Reşat Ustabaş ◽

Yelda Bingöl Alpaslan ◽

Fatih Eyduran ◽

Nazan Ocak İskeleli

Keyword(s):

Electronic Structure ◽

Experimental and theoretical investigation of the molecular and electronic structure ofN-cyclohexyl-2-[5-(4-pyridyl)-4-(p-tolyl)-4H-1,2,4-triazol-3-ylsulfanyl]acetamide dihydrate

Acta Crystallographica Section A Foundations of Crystallography ◽

10.1107/s0108767309094215 ◽

2009 ◽

Vol 65 (a1) ◽

pp. s274-s274

Author(s):

Muharrem Dinçer ◽

Namık Özdemir ◽

Ahmet Çetin ◽

Tekin Keser

Keyword(s):

Electronic Structure ◽

An experimental and theoretical investigation of the molecular and electronic structure of 2-amino-4-chloro-6-pyrazolyl-[1,3,5]triazine, forming supramolecular linear tapes in the solid state

New Journal of Chemistry ◽

10.1039/b711136c ◽

2008 ◽

Vol 32 (2) ◽

pp. 358-364 ◽

Cited By ~ 3

Author(s):

Maurizio Casarin ◽

Federica Garau ◽

Magda Monari ◽

Luciano Pandolfo ◽

Claudio Pettinari ◽

...

Keyword(s):

Electronic Structure ◽

Solid State ◽

A theoretical investigation on the molecular and electronic structure of the SFn compounds n=1–5 and their singly charged negative ions

The Journal of Chemical Physics ◽

10.1063/1.462415 ◽

1992 ◽

Vol 96 (10) ◽

pp. 7623-7632 ◽

Cited By ~ 36

Author(s):

Tom Ziegler ◽

G. L. Gutsev

Keyword(s):

Electronic Structure ◽

Negative Ions ◽

Singly Charged ◽