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Original Articles

Electron Density Distributions in Molecules

Pages 169-200 | Received 01 Jan 1989, Published online: 23 Sep 2006

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E.B. Starikov. (1993) On the electronic subsystem of nucleic acid crystallohydrates. Molecular Physics 80:6, pages 1459-1467.
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E.B. Starikov. (1993) On the convergence of the hartree-fock selfconsistency procedure. Molecular Physics 78:2, pages 285-305.
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Aravindhan Ganesan, Feng Wang, Michael Brunger & Kevin Prince. (2011) Effects of alkyl side chains on properties of aliphatic amino acids probed using quantum chemical calculations. Journal of Synchrotron Radiation 18:5, pages 733-742.
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Rajul Ranjan Choudhury, R. Chitra, Frédéric Capet & Pascal Roussel. (2011) Complete topological analysis of electron density obtained by maximum entropy method and its comparison with the theoretical electron density: A case study of 2-aminopyridinium maleate. Journal of Molecular Structure 994:1-3, pages 44-54.
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Fang-Fang Chen & Feng Wang. (2009) Electronic Structure of the Azide Group in 3¢-Azido-3¢-deoxythymidine (AZT) Compared to Small Azide Compounds. Molecules 14:7, pages 2656-2668.
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Birger Dittrich, John E. Warren, Francesca P. A. Fabbiani, Wolfgang Morgenroth & Ben Corry. (2009) Temperature dependence of rotational disorder in a non-standard amino acid from X-ray crystallography and molecular dynamics simulation. Physical Chemistry Chemical Physics 11:15, pages 2601.
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Dmitry V. Gutsulyak, Lyudmila G. Kuzmina, Judith A. K. Howard, Sergei F. Vyboishchikov & Georgii I. Nikonov. (2008) Cp(Pr i 2 MeP)FeH 2 SiR 3 :  Nonclassical Iron Silyl Dihydride . Journal of the American Chemical Society 130:12, pages 3732-3733.
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J M Zuo. (2004) Measurements of electron densities in solids: a real-space view of electronic structure and bonding in inorganic crystals. Reports on Progress in Physics 67:11, pages 2053-2103.
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Manfred Schlosser. 2001. Organometallics in Synthesis: A Manual. Organometallics in Synthesis: A Manual 1 352 .
Tibor S. Koritsanszky & Philip Coppens. (2001) Chemical Applications of X-ray Charge-Density Analysis. Chemical Reviews 101:6, pages 1583-1628.
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J. Autschbach & W. H. E. Schwarz. (2000) Where Do the Forces in Molecules Come from? A Density Functional Study of N 2 and HCl . The Journal of Physical Chemistry A 104:25, pages 6039-6046.
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G.U. Kulkarni, R.S. Gopalan & C.N.R. Rao. (2000) Experimental and theoretical electronic charge densities in molecular crystals. Journal of Molecular Structure: THEOCHEM 500:1-3, pages 339-362.
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Boris K. Vainshtein, Vladimir M. Fridkin & Vladimir L. IndenbomBoris K. Vainshtein, Vladimir M. Fridkin & Vladimir L. Indenbom. 2000. Modern Crystallography 2. Modern Crystallography 2 400 491 .
E.B Starikov. (1997) Chemical physics of solid-state nucleic acids: new intriguing horizons. Physics Reports 284:1-2, pages 1-89.
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Mark A. Spackman & Patrick G. Byrom. (1997) A novel definition of a molecule in a crystal. Chemical Physics Letters 267:3-4, pages 215-220.
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J.E. Niu, W.H.E. Schwarz & K. Ruedenberg. (1997) Electron densities and pπ-AO occupancies in π-bonded systems. Journal of Molecular Structure: THEOCHEM 389:1-2, pages 117-128.
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J.E. Niu & W.H.E. Schwarz. (1996) Electron density distributions of π bonds. Chemical Physics Letters 249:3-4, pages 218-223.
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Boris K. Vainshtein, Vladimir M. Fridkin & Vladimir L. IndenbomBoris K. Vainshtein, Vladimir M. Fridkin & Vladimir L. Indenbom. 1995. Structure of Crystals. Structure of Crystals 400 491 .
E. B. Starikov. (2004) Three‐dimensional Hartree–Fock crystal‐orbital calculation on crystalline diprotonated deoxycytidine‐5′‐monophosphate monohydrate: Toward rationalizing nucleic acid semiconductivity. Biopolymers 34:7, pages 921-932.
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Manfred Schlosser. 1994. Organometallics in Synthesis. Organometallics in Synthesis 1 166 .
Peter Luger. (2006) Crystal Structure Analysis at Normal and Low Temperature Conditions. Crystal Research and Technology 28:6, pages 767-794.
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