H in Rutile

• Johnson OW, Ohlsen WD, Kingsbury PI (1968) Defects in rutile. III. Optical and electrical properties of impurities and charge carriers, Physical. Review 175, 1102–1109.  

• Beran A, Zemann J (1971) Messung des Ultrarot-Pleochroismus von Mineralen. XI. Der Pleochroismus der OH-Streckfrequenz in Rutil, Anatas, Brookit und Cassiterit. Tschermaks Mineral Petrogr Mitt 15, 71-80.
• Johnson OW, DeFord J, Shaner JW (1973) Experimental technique for the precise determination of H and D concentration in rutile (TiO₂). Journal of Applied Physics 44, 3008-3012.

• Hammer VMF (1988) Quantitative IR-spectroscopic determination of structural OH-groups in natural rutiles of various occurrences. Z Kristallogr 185, 631.
• Hammer VMF (1989) IR-spektroskopisch bestimmte OH-Gehalte von Rutil und Titanit aus unterschiedlichen Paragenesen. — Mitteilungen der Österreichischen Mineralogischen Gesellschaft 134, 7-16.

• Hammer V (1990) IR spectroscopic and chemical study of a rutile from Modriach/Steiermark. Mitteilungen der Abteilung fuer Mineralogie am Landesmuseum Joanneum 58, 11-14.(in German)
• Rossman GR, Smyth JR (1990) Hydroxyl contents of accessory minerals in mantle eclogites and related rocks. American Mineralogist 75, 765-780
• Hammer VMF, Beran A (1991) Variations in the OH concentration of rutiles from different geological enviroinments. Mineralogy Petrology 45, 1-9.
• Bell DR, Rossman GR (1992) Water in Earth's Mantle: The Role of Nominally Anhydrous Minerals. Science 255, 1391-1397. 
• Vlassopoulos D, Rossman GR, Haggerty SE (1993) Coupled substitution of H and minor elements in rutile and implications of high OH contents in Nb-Cr rutile from the upper mantle. American Mineralogist 78, 1181-1191.
• Swope R, Smyth J, Larson A (1995) H in rutile compounds: I. Single-crystal neutron and X-ray diffraction study of H in rutile. American Mineralogist 80. :448–453.

• Maldener J, Rauch F, Gavranic M, Beran A (2001) OH absorption cofficients of rutile and cassiterite deduced from nuclear reaction analysis and FTIR spectroscopy. Mineralogy Petrology 71, 21-29.
• Beran A, Libowitzky E (2003) IR Spectroscopic Characterization fo OH Defects in Mineral Phases.  Phase Transitions 76, 1-15.
• Bromiley GD, Hilairet N, McCammon C (2004) Solubility of hydrogen and ferric iron in rutile and TiO₂ (II): implications for phase assemblages during ultrahigh-pressure metamorphism and for the stability of silica polymorphs in the lower mantle. Geophys Research Letters 31, L04610.
• Koudriachova MV, de Leeuw SW, Harrison NM (2004) First-principles study of H intercalation in rutile TiO2. Physical Review B 70, 165421
• Bromiley GD, Hilaret N (2005) An investigation of hydrogen and minor element incorporation in synthetic rutile. Mineralogical Magazine 69, 345–358.
• Bromiley GD, Shiryaev AA (2006) Neutron irradiation and post-irradiation annealing of rutile (TiO_2-x): effect on hydrogen incorporation and optical absorption. Physics and Chemistry of Minerals 33, 426-434.
• Johnson EA (2006) Water in Nominally Anhydrous Crustal Minerals: Speciation, Concentration, and Geologic Significance.Reviews in Mineralogy & Geochemistry 62, 117-154,   
• Katayama I, Nakashima S, Yurijmoto H (2006) Water content in natural eclogite and implication for water transport into the deep upper mantle. Lithos 86, 245-259.
• Konzett J, Libowitzky E, Hejny C, Miller C, Zanetti A (2008) Oriented quartz+calcic amphibole inclusions in omphacite from the Saualpe and Pohorje Mountain eclogites, Eastern Alps - An assessment of possible formation mechanisms based on IR- and mineral chemical data and water storage in EasternAlpine eclogites. Lithos 106, 336-350.
• Takahashi K, Yui H (2009) Analysis of Surface OH Groups on TiO₂ Single Crystal with Polarization Modulation Infrared External Reflection Spectroscopy. Journal of Physical Chemistry 113, 20322-20327.

• Bjørheim TS, Stolen S, Norby T, (2010) Ab Initio Studies of Hydrogen and Acceptor Defects in Rutile TiO2. Physical Chemistry Chemical Physics 12, 6817– 6825.  DOI: 10.1039/b925823j
  
• Colasanti CV, Johnson EA, Manning CE (2011) An experimental study of OH solubility rutile at 500-900 C, 0.5-2 GPa, and a range of oxygen fugacities/ American Mineralogist 96, 1291-1299
• Yang Y, Xia Q, Feng M, Gu X (2011) In-situ FTIR investigations at varying temperatures on hydrous components in rutile - American Mineralogist 96, 1851-1855. 
• Lucassen F, Koch-Muller M, Taran M, Franz G (2012) Coupled H and Nb,Cr and V gtrace element behavior in synthetic rutile at 600 C, 400 MPa and possible geological application. American Mineralogist 98, 7-18.
• Guo H (2017) In-situ infrared spectra of OH in rutile up to 1000 C. Physics and Chemistry of Minerals 44, 547-522.

• Wang S, Zhang JH, Smyth JR, Zhang JF, Liu D, Zhu X, Wang X, Ye Y (2020) Crystal Structure, Thermal Expansivity and High-Temperature Vibrational Spectra on Natural Hydrous Rutile. Journal of earth Science.  DOI: 10.1007/s12583-020-1351-5. 
• Palfey WR, Rossman GR, Goddard WA III (2021) Structure, Energetics, and Spectra for the Oxygen Vacancy in Rutile: Prominence of the Ti–H_O–Ti Bond. Journal of Physiical Chemistry Letters, 12, 10175– 10181,  DOI: 10.1021/acs.jpclett.1c02850 
• Lueder M, Tamblyn R, Hermann J (2023) A framework for quantitative in situ evaluation of coupled substitutions between H+ and trace elements in natural rutile. European Journal of Meralogy 35, 243–265,  
• Wang S,Su Y, Wang Q, Smyth JR, Liu D, Zhu X, iao Y, Hu Y, Ye Y (2023) Crystal Structure, Vibrational Spectra on Trivalent-Cation-Doped
  Rutile and Application in Optical Materials. The Journal of Physical Chemistry C 127, 12160-12170. DOI: 10.1021/acs.jpcc.3c00400