How much tetraradical character is present in the Si6Ge9 cluster? (English)
- New search for: Casanova, David
- New search for: Casanova, David
In:
Journal of Computational Chemistry
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35
, 12
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944-949
;
2014
- Article (Journal) / Electronic Resource
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Title:How much tetraradical character is present in the Si6Ge9 cluster?
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Contributors:Casanova, David ( author )
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Published in:Journal of Computational Chemistry ; 35, 12 ; 944-949
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Publisher:
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Publication date:2014-05-05
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Size:7 pages
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ISSN:
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DOI:
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Type of media:Article (Journal)
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Type of material:Electronic Resource
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Language:English
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Keywords:
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Source:
Table of contents – Volume 35, Issue 12
The tables of contents are generated automatically and are based on the data records of the individual contributions available in the index of the TIB portal. The display of the Tables of Contents may therefore be incomplete.
- 891
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Towards the design of novel boron‐ and nitrogen‐substituted ammonia‐borane and bifunctional arene ruthenium catalysts for hydrogen storageBandaru, Sateesh / English, Niall J. / Phillips, Andrew D. / MacElroy, J.M.D. et al. | 2014
- 904
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Exchange coupling and magnetic anisotropy in a family of bipyrimidyl radical‐bridged dilanthanide complexes: Density functional theory and ab initio calculationsZhang, Yi‐Quan / Luo, Cheng‐Lin / Zhang, Qiang et al. | 2014
- 910
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Cooperativity and cluster growth patterns in acetonitrile: A DFT studyRemya, Karunakaran / Suresh, Cherumuttathu H. et al. | 2014
- 923
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Metalophilic interaction in gold halide: Quantum chemical study of AuX (X = Fat)Li, Xinying et al. | 2014
- 932
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A Bayesian statistical approach of improving knowledge‐based scoring functions for protein–ligand interactionsGrinter, Sam Z. / Zou, Xiaoqin et al. | 2014
- 944
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How much tetraradical character is present in the Si6Ge9 cluster?Casanova, David et al. | 2014
- 950
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Rapid determination of RMSDs corresponding to macromolecular rigid body motionsPopov, Petr / Grudinin, Sergei et al. | 2014
- 957
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ST‐analyzer: A web‐based user interface for simulation trajectory analysisJeong, Jong Cheol / Jo, Sunhwan / Wu, Emilia L. / Qi, Yifei / Monje‐Galvan, Viviana / Yeom, Min Sun / Gorenstein, Lev / Chen, Feng / Klauda, Jeffery B. / Im, Wonpil et al. | 2014
- i
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Cover Image, Volume 35, Issue 12| 2014