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Original Articles

Diffraction experiments and the theory of simple transition-metal complexes

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Pages 265-272 | Published online: 11 Aug 2008

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By DYLAN JAYATILAKA and GRAHAM S. CHANDLER. (1997) Spatial symmetry and equivalence with unrestricted Hartree-Fock wavefunctions: application to the prediction of spin densities. Molecular Physics 92:3, pages 471-476.
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B.N. Figgis, P.A. Reynolds & J.W. Cable. (1993) Spatial distribution of magnetization in the anisotropic Co(H2O)2+ 6 ion from polarized neutron diffraction. Molecular Physics 80:6, pages 1377-1388.
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L.A. Barnes, G.S. Chandler & B.N. Figgis. (1989) Orbital magnetization in CoCl2- 4 and Co(phthalocyanine) from polarized neutron diffraction. Molecular Physics 68:3, pages 711-735.
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Ronald Mason. (1986) Wavefunctions in molecular crystals. International Reviews in Physical Chemistry 5:2-3, pages 259-264.
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Articles from other publishers (10)

Jack T. Surek & David D. Thomas. (2008) A paramagnetic molecular voltmeter. Journal of Magnetic Resonance 190:1, pages 7-25.
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Yang Jinlong, Wang Kelin, L. F. Don� dalle Rose & F. Toigo. (1991) Electronic structure and spectrum of Cr3+ in LiCaAlF6. Zeitschrift f�r Physik B Condensed Matter 84:2, pages 255-261.
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Philip A. Reynolds & Brian N. Figgis. (1991) Spin-dependent covalence in from neutron diffraction . Physical Review B 43:10, pages 8661-8664.
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P A Reynolds & B N Figgis. (1991) On covalence in anhydrous copper (II) sulphate from polarized neutron diffraction. Journal of Physics: Condensed Matter 3:13, pages 1977-1983.
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Hartmut Fuess. 1991. The Application of Charge Density Research to Chemistry and Drug Design. The Application of Charge Density Research to Chemistry and Drug Design 225 240 .
P J Brown, B N Figgis & P A Reynolds. (1990) Covalency in FeF 2 from magnetisation density data and from ab initio theory . Journal of Physics: Condensed Matter 2:24, pages 5297-5308.
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D. M. Wang & E. de Boer. (1990) Electron paramagnetic resonance, electron nuclear double resonance, and electron spin echo envelope modulation of Fe(CN)3−6 in a KCl lattice. The Journal of Chemical Physics 92:8, pages 4698-4707.
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. (1997) Spin-density [V(D 2 O) 6 ] 2+ in ammonium-vandium Tutton salt : the metal-water bond . Proceedings of the Royal Society of London. A. Mathematical and Physical Sciences 421:1860, pages 153-168.
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. (1997) The magnetization density of hexacyanoferrate(III) ion measured by polarized neutron diffraction in Cs 2 KFe(CN) 6 . Proceedings of the Royal Society of London. A. Mathematical and Physical Sciences 419:1857, pages 205-219.
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Robert J. Deeth, Brian N. Figgis & Mark I. Ogden. (1988) Spin densities and covalency in transition-metal complexes: A comparison of discrete variational Xα calculations with polarised neutron diffraction data. Chemical Physics 121:1, pages 115-130.
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