Current Inorganic Chemistry (Discontinued)

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Volume: 3 Issue: 3, September 2014



Editorial (Thematic Issue: New Frontiers in Computational Inorganic Chemistry) free to download

Volume:3   Issue: 3
Pp: 195-195
Michael Filatov
DOI: 10.2174/1877944104999140115154328
Published on: 15 January, 2014

Computational Studies of Photodissociation, Photoinduced Isomerization, and Stereochemistry of Coordination Complexes

Volume:3   Issue: 3
Pp: 196-212
Justyna M. Zurek and Martin J. Paterson
DOI: 10.2174/1877944103666140110225337
Published on: 10 January, 2014

Optimizing the Structure of Tetracyanoplatinate (II): A Comparison of Relativistic Density Functional Theory Methods open access plus

Volume:3   Issue: 3
Pp: 213-219
Asmus O. Dohn, Klaus B. Moller and Stephan P. A. Sauer
DOI: 10.2174/1877944103666140110230100
Published on: 10 January, 2014

Exploring Bonding in Heavy Atom Chemistry with Dirac-Exact Methods

Volume:3   Issue: 3
Pp: 220-234
Wenli Zou, Michael Filatov and Dieter Cremer
DOI: 10.2174/1877944103666140110230538
Published on: 10 January, 2014

Analysis of the Magnetic Exchange Interaction in Halide-Bridged Cu(II) Binuclear Complexes: Deciphering the Paths

Volume:3   Issue: 3
Pp: 235-241
Boris Le Guennic and Nicolas Ferré
DOI: 10.2174/1877944103666140110225547
Published on: 10 January, 2014

Modeling Transition Metal Complexes in the Framework of the Spin-Crossover Phenomenon: A DFT Perspective

Volume:3   Issue: 3
Pp: 242-259
Latevi Max Lawson Daku
DOI: 10.2174/1877944103666140110231029
Published on: 10 January, 2014

Estimation of Electronic Coupling for Charge Transfer in Bioinorganic Molecules

Volume:3   Issue: 3
Pp: 260-269
Alexander A. Voityuk
DOI: 10.2174/1877944103666140110230337
Published on: 10 January, 2014

On the Use of Locally Dense Basis Sets in the Calculation of EPR Hyperfine Couplings: A Study on Model Systems for Bio-Inorganic Fe and Co Complexes open access plus

Volume:3   Issue: 3
Pp: 270-283
Birgitte O. Milhoj, Erik D. Hedegard and Stephan P. A. Sauer
DOI: 10.2174/1877944103666140110225818
Published on: 10 January, 2014

Relativistic Calculation of Hyperfine Parameters of Mercury Compounds

Volume:3   Issue: 3
Pp: 284-290
Michael Filatov, Wenli Zou and Dieter Cremer
DOI: 10.2174/1877944103666140110230901
Published on: 10 January, 2014

Acknowledgements to Reviewers:

Volume:3   Issue: 3
Pp: 291-291

DOI: 10.2174/187794410303140219205212
Published on: 19 February, 2014