Literature DB >> 9938299

Density-functional approximation for the correlation energy of the inhomogeneous electron gas.

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Abstract

Year:  1986        PMID: 9938299     DOI: 10.1103/physrevb.33.8822

Source DB:  PubMed          Journal:  Phys Rev B Condens Matter        ISSN: 0163-1829


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  838 in total

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2.  Influence of the heme pocket conformation on the structure and vibrations of the Fe-CO bond in myoglobin: a QM/MM density functional study.

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Journal:  Biophys J       Date:  2001-07       Impact factor: 4.033

3.  Experimental determination and calculations of redox potential descriptors of compounds directed against retroviral zinc fingers: Implications for rational drug design.

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4.  β-Nitro-5,10,15-tritolylcorroles.

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Journal:  Inorg Chem       Date:  2012-06-05       Impact factor: 5.165

5.  Self-assembly of dinitrosyl iron units into imidazolate-edge-bridged molecular squares: characterization including Mössbauer spectroscopy.

Authors:  Jennifer L Hess; Chung-Hung Hsieh; Scott M Brothers; Michael B Hall; Marcetta Y Darensbourg
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6.  Evaluation of the influence of anisotropic indirect nuclear spin-spin coupling tensors on effective residual dipolar couplings for model peptides.

Authors:  David L Bryce; Roderick E Wasylishen
Journal:  J Biomol NMR       Date:  2003-01       Impact factor: 2.835

7.  The Eponymous Cofactors in Cytochrome P460s from Ammonia-Oxidizing Bacteria Are Iron Porphyrinoids Whose Macrocycles Are Dibasic.

Authors:  Meghan A Smith; Kyle M Lancaster
Journal:  Biochemistry       Date:  2017-12-06       Impact factor: 3.162

8.  TCNE-aniline charge transfer complex: ab initio and TDDFT investigations in gas phase.

Authors:  Tapas Manna; Sumanta Bhattacharya
Journal:  J Mol Model       Date:  2009-01-27       Impact factor: 1.810

9.  Structural characterization of the P1+ intermediate state of the P-cluster of nitrogenase.

Authors:  Stephen M Keable; Oleg A Zadvornyy; Lewis E Johnson; Bojana Ginovska; Andrew J Rasmussen; Karamatullah Danyal; Brian J Eilers; Gregory A Prussia; Axl X LeVan; Simone Raugei; Lance C Seefeldt; John W Peters
Journal:  J Biol Chem       Date:  2018-05-02       Impact factor: 5.157

10.  Terminal vs bridging hydrides of diiron dithiolates: protonation of Fe2(dithiolate)(CO)2(PMe3)4.

Authors:  Riccardo Zaffaroni; Thomas B Rauchfuss; Danielle L Gray; Luca De Gioia; Giuseppe Zampella
Journal:  J Am Chem Soc       Date:  2012-11-13       Impact factor: 15.419

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