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Comments on Inorganic Chemistry
A Journal of Critical Discussion of the Current Literature
Volume 15, 1994 - Issue 3-4
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Original Articles

The Influence of Vibronic Coupling on the Spectroscopic Properties and Stereochemistry of Simple 4- and 6-Coordinate Copper(II) Complexes

Pages 197-254 | Received 03 Aug 1993, Published online: 23 Sep 2006

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R. Valiente, F. Rodríguez, M.T. Barriuso, J.A. Aramburu & M. Moreno. (1999) Dependence of the Cl− → Cu2+ charge transfer with hydrostatic pressure in the pure and Cu-doped A2MCl4 (M = Mn, Cd, Cu) layer perovskite. Structural correlations. Radiation Effects and Defects in Solids 151:1-4, pages 285-291.
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B. Baticle, F. Rodríguez & R. Valiente. (1995) Polarized charge transfer spectra of Cu2+ doped perovskite layers (RNH3)2CdxMn1−xCl4(x = 0−1). Radiation Effects and Defects in Solids 135:1-4, pages 89-94.
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Marina T. Candela, Enrique Jara, Fernando Aguado, Rafael Valiente & Fernando Rodríguez. (2020) Structural Correlations in Jahn–Teller Systems of Mn 3+ and Cu 2+ : Unraveling Local Structures through Spectroscopic Techniques . The Journal of Physical Chemistry C 124:41, pages 22692-22703.
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Fernando Rodríguez. (2017) Unveiling the Local Structure of Cu 2+ Ions from d-Orbital Splitting. Application to K 2 ZnF 4 :Cu 2+ and KZnF 3 :Cu 2+ . Inorganic Chemistry 56:4, pages 2029-2036.
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Fernando Rodríguez. 2017. Correlations in Condensed Matter under Extreme Conditions. Correlations in Condensed Matter under Extreme Conditions 3 15 .
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Charles J. Simmons, Horst Stratemeier, Michael A. Hitchman & Mark J. Riley. (2013) Influence of Lattice Interactions on the Jahn–Teller Distortion of the [Cu(H 2 O) 6 ] 2+ Ion: Dependence of the Crystal Structure of K 2 x Rb 2–2 x [Cu(H 2 O) 6 ](SeO 4 ) 2 upon the K/Rb Ratio . Inorganic Chemistry 52:18, pages 10481-10499.
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Malcolm A. Halcrow. (2013) Jahn–Teller distortions in transition metal compounds, and their importance in functional molecular and inorganic materials. Chem. Soc. Rev. 42:4, pages 1784-1795.
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Rebecca Docherty, Floriana Tuna, Colin A. Kilner, Eric J. L. McInnes & Malcolm A. Halcrow. (2012) Suppression of the Jahn–Teller distortion in a six-coordinate copper(ii) complex by doping it into a host lattice. Chemical Communications 48:34, pages 4055.
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Lutz M. Engelhardt, Lisbeth Grøndahl, Jack M. Harrowfield, Stephen F. Ralph, Alan M. Sargeson, Brian W. Skelton, Alexandre N. Sobolev & Allan H. White. (2011) Copper(II) environments in some macrobicycle complexes at room and low temperatures: some novel binuclear chloro-bridged systems. Journal of Inclusion Phenomena and Macrocyclic Chemistry 71:3-4, pages 353-362.
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Susana Gómez, Iñigo Urra, Rafael Valiente & Fernando Rodríguez. (2011) Spectroscopic study of Cu2+/Cu+ doubly doped and highly transmitting glasses for solar spectral transformation. Solar Energy Materials and Solar Cells 95:8, pages 2018-2022.
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Charles J. Simmons, Horst Stratemeier, Michael A. Hitchman, Dirk Reinen, Vanessa M. Masters & Mark J. Riley. (2011) Temperature Dependence of the Crystal Structure and g -Values of trans -Diaquabis(methoxyacetato)Copper(II): Evidence for a Thermal Equilibrium Between Complexes with Tetragonally Elongated and Compressed Geometries . Inorganic Chemistry 50:11, pages 4900-4916.
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Susana Gomez, Iñigo Urra, Rafael Valiente & Fernando Rodriguez. (2010) Spectroscopic study of Cu 2 + and Cu + ions in high-transmission glass. Electronic structure and Cu 2 + /Cu + concentrations . Journal of Physics: Condensed Matter 22:29, pages 295505.
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Colin A. Kilner & Malcolm A. Halcrow. (2010) Change in electronic structure in a six-coordinate copper(II) complex accompanied by an anion order/disorder transition. Acta Crystallographica Section B Structural Science 66:2, pages 206-212.
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J Ruiz-Fuertes, M N Sanz-Ortiz, J González, F Rodríguez, A Segura & D Errandonea. (2010) Optical absorption and Raman spectroscopy of CuWO 4 . Journal of Physics: Conference Series 215, pages 012048.
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Robert J. Deeth. 2010. Theoretical and Computational Inorganic Chemistry. Theoretical and Computational Inorganic Chemistry 1 39 .
Fernando Rodriguez. 2010. High-Pressure Crystallography. High-Pressure Crystallography 215 229 .
Marta N. Sanz-Ortiz & Fernando Rodríguez. (2009) Photoluminescence properties of Jahn–Teller transition-metal ions. The Journal of Chemical Physics 131:12.
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Peter Comba & Marion Kerscher. 2009. Activating Unreactive Substrates. Activating Unreactive Substrates 53 63 .
Robert J. Deeth, Anna E. Anastasi & Kris Randell. (2009) Ligand field torque: a π-type electronic driving force for determining ligand rotational preferences. Dalton Transactions:30, pages 6007.
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Kieran S. Hadler, James R. Kilmartin, Graeme R. Hanson, Michael A. Hitchman, Charles J. Simmons & Mark J. Riley. (2008) Vibronic Effects in Cu(II)-Doped Ba 2 Zn(HCO 2 ) 6 ·4H 2 O . Inorganic Chemistry 47:18, pages 8188-8196.
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Michael A. Hitchman, David C. R. Hockless, Brian W. Skelton, Horst Stratemeier & Allan H. White. (2007) Crystal Structures and EPR Spectra of Cu 2+ ‐Doped Magnesium(II) and Cadmium(II) Methoxyacetates . Zeitschrift für anorganische und allgemeine Chemie 633:11-12, pages 2004-2008.
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F Aguado, F Rodríguez, R Valiente, M Hanfland & J P Itié. (2007) Variation of the Jahn–Teller distortion with pressure in the layered perovskite Rb 2 CuCl 4 : local and crystal compressibilities . Journal of Physics: Condensed Matter 19:34, pages 346229.
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Robert J. Deeth. (2007) Comprehensive Molecular Mechanics Model for Oxidized Type I Copper Proteins:  Active Site Structures, Strain Energies, and Entatic Bulging. Inorganic Chemistry 46:11, pages 4492-4503.
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Frank Neese, Taras Petrenko, Dmitry Ganyushin & Gottfried Olbrich. (2007) Advanced aspects of ab initio theoretical optical spectroscopy of transition metal complexes: Multiplets, spin-orbit coupling and resonance Raman intensities. Coordination Chemistry Reviews 251:3-4, pages 288-327.
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Fernando Rodríguez, Fernando Aguado, Jean-Paul Itié & Michel Hanfland. (2007) Structural Correlation in Jahn–Teller Systems of Cu 2+ and Mn 3+ under Pressure . Journal of the Physical Society of Japan 76:Suppl.A, pages 1-4.
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Paul V. Bernhardt, Richard Bramley, Rodney J. Geue, Stephen F. Ralph & Alan M. Sargeson. (2007) An expanded cavity hexaamine cage for copper(ii). Dalton Transactions:12, pages 1244.
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F. Rodríguez, F. Aguado, R. Valiente, M. Hanfland & J. P. Itiè. (2006) Variation of the Jahn–Teller distortion with pressure in perovskite layers A 2 CuCl 4 . Influence on the charge‐transfer band . physica status solidi (b) 244:1, pages 156-161.
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Charles J. Simmons, Horst Stratemeier, Michael A. Hitchman & Mark J. Riley. (2006) Influence of Lattice Interactions on the Jahn−Teller Distortion of the [Cu(H 2 O) 6 ] 2+ Ion:  Dependence of the Crystal Structure of K 2 [Cu(H 2 O) 6 ](SO 4 ) 2 x (SeO 4 ) 2 - 2 x upon the Sulfate/Selenate Ratio . Inorganic Chemistry 45:3, pages 1021-1031.
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Robert J. Deeth & Laura J. A. Hearnshaw. (2006) Molecular modelling of Jahn–Teller distortions in Cu( ii )N 6 complexes: elongations, compressions and the pathways in between . Dalton Trans.:8, pages 1092-1100.
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Wataru Kosaka, Tohru Ishihara, Hisashi Yashiro, Yayoi Taniguchi, Kazuhito Hashimoto & Shin-ichi Ohkoshi. (2005) Synthesis of Ferromagnetic CsCuCr Prussian Blue Analogue with a Tetragonal Structure. Chemistry Letters 34:9, pages 1278-1279.
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Charles J. Simmons, Horst Stratemeier, Graeme R. Hanson & Michael A. Hitchman. (2005) Temperature Dependence of the Crystal Structure and g -Values of [(HC(Ph 2 PO) 3 ) 2 Cu](ClO 4 ) 2 ·2H 2 O:  Influence of Dynamic Jahn−Teller Coupling and Lattice Strain Interactions . Inorganic Chemistry 44:8, pages 2753-2760.
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F. Aguado, F. Rodríguez, R. Valiente, J. P. Itié & P. Munsch. (2004) Pressure-induced Jahn-Teller suppression in : Pseudo-Jahn-Teller effect . Physical Review B 70:21.
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F Aguado, F Rodríguez, R Valiente, A Señas & I Goncharenko. (2004) Three-dimensional magnetic ordering in the Rb 2 CuCl 4 layer perovskite—structural correlations . Journal of Physics: Condensed Matter 16:12, pages 1927-1938.
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Colin A. Kilner, Eric J. L. McInnes, Michael A. Leech, Godfrey S. Beddard, Judith A. K. Howard, Frank E. Mabbs, David Collison, Adam J. Bridgeman & Malcolm A. Halcrow. (2004) A crystallographic, EPR and theoretical study of the Jahn–Teller distortion in [CuTp 2 ] (Tp − = tris{pyrazol-1-yl}hydridoborate) . Dalton Trans.:2, pages 236-243.
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F. Rodriguez. 2004. High-Pressure Crystallography. High-Pressure Crystallography 341 352 .
Peter Comba, Andreas Hauser, Marion Kerscher & Hans Pritzkow. (2003) Bond‐Stretch Isomerism: Trapped Isomeric Structures of Hexacoordinate Copper( II ) Bispidine Chromophores along a Jahn–Teller Active Vibrational Coordinate . Angewandte Chemie International Edition 42:37, pages 4536-4540.
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Peter Comba, Andreas Hauser, Marion Kerscher & Hans Pritzkow. (2003) Bindungsdehnungsisomerie: lokalisierte Strukturen von sechsfach koordinierten Kupfer( II )‐Bispidinkomplexen entlang einer Jahn‐Teller‐aktiven Vibrationsmode . Angewandte Chemie 115:37, pages 4675-4679.
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Fernando Rodriguez & Fernando Aguado. (2003) Correlations between structure and optical properties in Jahn–Teller Mn3+ fluorides: A study of TlMnF4 and NaMnF4 under pressure. The Journal of Chemical Physics 118:24, pages 10867-10875.
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Malcolm A. Halcrow. (2003) Interpreting and controlling the structures of six-coordinate copper( ii ) centres – When is a compression really a compression? . Dalton Trans.:23, pages 4375-4384.
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Michael A. Hitchman, Yurii V. Yablokov, Vladimir E. Petrashen, Maria A. Augustyniak-Jabłokov, Horst Stratemeier, Mark J. Riley, Kazimierz Łukaszewicz, Paweł E. Tomaszewski & Adam Pietraszko. (2002) Dynamic Behavior of the Jahn−Teller Distorted Cu(H 2 O) 6 2+ Ion in Cu 2+ Doped Cs 2 [Zn(H 2 O) 6 ](ZrF 6 ) 2 and the Crystal Structure of the Host Lattice . Inorganic Chemistry 41:2, pages 229-238.
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R. Valiente, F. Rodríguez, J. A. Aramburu, M. Moreno, M. T. Barriuso, C. Sousa & C. de Graaf. (2001) Optical spectroscopy of (C 2 H 5 NH 3 ) 2 CdCl 4 :Cu 2+ under pressure: Study of Cu 2+ local structure from theoretical calculations . International Journal of Quantum Chemistry 86:2, pages 239-244.
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S.K. Hoffmann, J. Goslar, W. Hilczer, M.A. Augustyniak-Jabłokow & S. Kiczka. (2001) Dephasing Relaxation of the Electron Spin Echo of the Vibronic Cu(H2O)6 Complexes in Tutton Salt Crystals at Low Temperatures. Journal of Magnetic Resonance 153:1, pages 56-68.
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Peter Comba & Achim Lienke. (2001) Bispidine Copper(II) Compounds:  Effects of the Rigid Ligand Backbone. Inorganic Chemistry 40:20, pages 5206-5209.
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S.K Hoffmann, J Goslar, W Hilczer, R Kaszyński & M.A Augustyniak-Jabłokow. (2001) Electron spin relaxation of the Jahn–Teller Cu(H2O)6 complex in Cs2Zn(SO4)2·6H2O crystals. Solid State Communications 117:5, pages 333-336.
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R. Valiente, F. Rodriguez, M. Moreno & L. Lezama. 2001. Vibronic Interactions: Jahn-Teller Effect in Crystals and Molecules. Vibronic Interactions: Jahn-Teller Effect in Crystals and Molecules 221 228 .
F. Rodríguez, M. Hanfland, J. P. Itié & A. Polian. 2001. Frontiers of High Pressure Research II: Application of High Pressure to Low-Dimensional Novel Electronic Materials. Frontiers of High Pressure Research II: Application of High Pressure to Low-Dimensional Novel Electronic Materials 143 153 .
M. A. Hitchman, C. J. Simmons & H. Stratemeier. (2000) EPR of two Cu2+ complexes showing dynamic Jahn-Teller effects. Applied Magnetic Resonance 19:1, pages 121-131.
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R. Valiente & F. Rodríguez. (1999) Electron-phonon coupling in charge-transfer and crystal-field states of Jahn-Teller systems . Physical Review B 60:13, pages 9423-9429.
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R Valiente, F Rodrı́guez, M Moreno & M Hitchman. (1999) Effect of pressure on the Cl−→Cu2+ charge transfer in A2CuCl4 layer perovskites (A=CnH2n+1NH3, n=2, 3) and (3-Chloroanilinium)8[CuCl6]Cl4: structural correlations. Physica B: Condensed Matter 265:1-4, pages 176-180.
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Rafael Valiente & Fernando Rodríguez. (1999) Thermochromic properties of the ferroelectric -doped : study of the temperature-induced dichroism. Journal of Physics: Condensed Matter 11:12, pages 2595-2606.
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Michael A. Hitchman, Wim Maaskant, Jaco van der Plas, Charles J. Simmons & Horst Stratemeier. (1999) Cooperative Jahn−Teller Interactions in Dynamic Copper(II) Complexes. Temperature Dependence of the Crystal Structure and EPR Spectrum of Deuterated Ammonium Copper(II) Sulfate Hexahydrate. Journal of the American Chemical Society 121:7, pages 1488-1501.
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R Valiente & F Rodríguez. (1998) Effects of chemical pressure on the charge-transfer spectra of complexes formed in -doped (M = Zn, Mn, Cd, Hg; X = Cl, Br). Journal of Physics: Condensed Matter 10:42, pages 9525-9534.
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Nayan K. Solanki, Eric J. L. McInnes, Frank E. Mabbs, Sanja Radojevic, Mary McPartlin, Neil Feeder, John E. Davies & Malcolm A. Halcrow. (1998) Sterische Kontrolle des elektronischen Grundzustands in Komplexen mit sechsfach koordiniertem Kupfer(II). Angewandte Chemie 110:16, pages 2344-2346.
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B.Amaya Moral & Fernando Rodriguez. (1997) Dependence of the charge transfer spectra of (C2H5NH3)2CdCl4 : Cu2+ with Hydrostatic pressure: Structural changes around Cu2+. Journal of Physics and Chemistry of Solids 58:9, pages 1487-1490.
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B. A. Moral, F. Rodríguez, R. Valiente, M. Moreno & H. U. Güdel. (1997) Local Structure of Cu 2+ in the (C 2 H 5 NH 3 ) 2 MCl 4 :Cu 2+ (M = Cd, Mn) Layer Perovskites. Influence of Hydrostatic Pressure in the 0–60 kbar Range* . Zeitschrift für Physikalische Chemie 201:1-2, pages 151-158.
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M. T. Barriuso, J. A. Aramburu, C. Daul & M. Moreno. (1997) A microscopic insight into oscillator strengths: The charge transfer bands for CuCl2-4. International Journal of Quantum Chemistry 61:3, pages 563-570.
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Rafael Valiente & Fernando Rodriguez. (1996) Polarized electronic spectra of the (CH3NH3)2Cd1 − xMnxCl4 (x = 0–1) perovskite layer doped with Cu2+: Study of the Cl− → Cu2+ charge transfer intensity enhancement along the series. Journal of Physics and Chemistry of Solids 57:5, pages 571-587.
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F. Blasco, L. Perelló, J. Latorre, J. Borrás & S. Garciá-Granda. (1996) Cobalt(II), Nickel(II), and Copper(II) complexes of sulfanilamide derivatives: Synthesis, spectroscopic studies, and antibacterial activity. Crystal structure of [Co(sulfacetamide)2(NCS)2]. Journal of Inorganic Biochemistry 61:2, pages 143-154.
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B. A. Moral, F. Rodríguez, R. Valiente, M. Moreno & H. U. Güdel. (1996) Local Structure of Cu 2+ in the (C 2 H 5 NH 3 ) 2 MCl 4 :Cu 2+ (M = Cd, Mn) Layer Perovskites. Influence of Hydrostatic Pressure in the 0–60 kbar Range* . Zeitschrift für Physikalische Chemie 1:1, pages 425-432.
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Frank Neese, Walter G. Zumft, William E. Antholine & Peter M. H. Kroneck. (1996) The Purple Mixed-Valence Cu A Center in Nitrous-oxide Reductase:  EPR of the Copper-63-, Copper-65-, and Both Copper-65- and [ 15 N]Histidine-Enriched Enzyme and a Molecular Orbital Interpretation . Journal of the American Chemical Society 118:36, pages 8692-8699.
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Wolfgang RauwHans AhsbahsMichael A. HitchmanSergei LukinDirk ReinenArthur J. SchultzCharles J. SimmonsHorst Stratemeier. (1996) Pressure Dependence of the Crystal Structures and EPR Spectra of Potassium Hexaaquacopper(II) Sulfate and Deuterated Ammonium Hexaaquacopper(II) Sulfate. Inorganic Chemistry 35:7, pages 1902-1911.
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R Valiente, M C Marco de Lucas & F Rodriquez. (1995) Charge-transfer spectra and dynamics of CuBr 4 2- in (N(CH 3 ) 4 ) 2 CdBr 4 :Cu 2+ crystals: a new first-order phase transition at T c2 =20 K . Journal of Physics: Condensed Matter 7:20, pages 3881-3894.
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Timothy Astley, Henrietta Headlam, Michael A. Hitchman, F. Richard Keene, John Pilbrow, Horst Stratemeier, Edward R. T. Tiekink & Y. C. Zhong. (1995) Crystal structures and electron paramagnetic resonance spectra of [Cu{P(C 5 H 4 N) 3 } 2 ]Br 2 ·8H 2 O and Cu 2+ -doped [Zn{P(C 5 H 4 N) 3 } 2 ]Br 2 ·8H 2 O, examples of a dynamic Jahn–Teller effect in two dimensions . J. Chem. Soc., Dalton Trans.:23, pages 3809-3818.
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R Valiente, M C Marco de Lucas & F Rodriguez. (1994) Polarized charge transfer spectroscopy of Cu 2+ in doped one-dimensional [N(CH 3 ) 4 ]CdCl 3 and [N(CH 3 ) 4 ]CdBr 3 crystals . Journal of Physics: Condensed Matter 6:24, pages 4527-4540.
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