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Short-range order in Li–Al tourmalines : IR spectroscopy, X-ray single crystal diffraction analysis and a bond valence theory approach. / Bronzova, Yuliya; Babushkina, Miriam; Frank-Kamenetskaya, Olga; Vereshchagin, Oleg; Rozhdestvenskaya, Ira; Zolotarev, Anatoly.

In: Physics and Chemistry of Minerals, Vol. 46, No. 9, 01.10.2019, p. 815-825.

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@article{affc0677f97046cf8f6fafd4f9f588ca,
title = "Short-range order in Li–Al tourmalines: IR spectroscopy, X-ray single crystal diffraction analysis and a bond valence theory approach",
abstract = "The short-range order in Li–Al–(OH−, F−) tourmalines with Y[Li/Al] ≈ 1 and different Na/Ca ratio was investigated by means of bond valence theory, experimental IR spectroscopic data and the results of X-ray single crystal diffraction. The stability of the arrangements coordinating W- and V-crystallographic sites occupied by OH−, F− and O2− ions was refined. A unified model of assignment of absorption bands in the IR spectra to the local arrangements (clusters) was suggested taking into account the first and the second OH−coordination spheres. The types of local cation arrangements around the W- and V-anion sites, alongside with clusters ratio and their distribution were brought out. The short-range order in Li–Al tourmalines controlled not only by local restrictions of the bond valence theory, but also by the long-range order was described.",
keywords = "Bond valence theory, Infrared spectroscopy, Li–Al tourmaline, Short-range ordering, X-ray single crystal diffraction",
author = "Yuliya Bronzova and Miriam Babushkina and Olga Frank-Kamenetskaya and Oleg Vereshchagin and Ira Rozhdestvenskaya and Anatoly Zolotarev",
year = "2019",
month = oct,
day = "1",
doi = "10.1007/s00269-019-01042-0",
language = "English",
volume = "46",
pages = "815--825",
journal = "Physics and Chemistry of Minerals",
issn = "0342-1791",
publisher = "Springer Nature",
number = "9",

}

RIS

TY - JOUR

T1 - Short-range order in Li–Al tourmalines

T2 - IR spectroscopy, X-ray single crystal diffraction analysis and a bond valence theory approach

AU - Bronzova, Yuliya

AU - Babushkina, Miriam

AU - Frank-Kamenetskaya, Olga

AU - Vereshchagin, Oleg

AU - Rozhdestvenskaya, Ira

AU - Zolotarev, Anatoly

PY - 2019/10/1

Y1 - 2019/10/1

N2 - The short-range order in Li–Al–(OH−, F−) tourmalines with Y[Li/Al] ≈ 1 and different Na/Ca ratio was investigated by means of bond valence theory, experimental IR spectroscopic data and the results of X-ray single crystal diffraction. The stability of the arrangements coordinating W- and V-crystallographic sites occupied by OH−, F− and O2− ions was refined. A unified model of assignment of absorption bands in the IR spectra to the local arrangements (clusters) was suggested taking into account the first and the second OH−coordination spheres. The types of local cation arrangements around the W- and V-anion sites, alongside with clusters ratio and their distribution were brought out. The short-range order in Li–Al tourmalines controlled not only by local restrictions of the bond valence theory, but also by the long-range order was described.

AB - The short-range order in Li–Al–(OH−, F−) tourmalines with Y[Li/Al] ≈ 1 and different Na/Ca ratio was investigated by means of bond valence theory, experimental IR spectroscopic data and the results of X-ray single crystal diffraction. The stability of the arrangements coordinating W- and V-crystallographic sites occupied by OH−, F− and O2− ions was refined. A unified model of assignment of absorption bands in the IR spectra to the local arrangements (clusters) was suggested taking into account the first and the second OH−coordination spheres. The types of local cation arrangements around the W- and V-anion sites, alongside with clusters ratio and their distribution were brought out. The short-range order in Li–Al tourmalines controlled not only by local restrictions of the bond valence theory, but also by the long-range order was described.

KW - Bond valence theory

KW - Infrared spectroscopy

KW - Li–Al tourmaline

KW - Short-range ordering

KW - X-ray single crystal diffraction

UR - http://www.scopus.com/inward/record.url?scp=85067406573&partnerID=8YFLogxK

U2 - 10.1007/s00269-019-01042-0

DO - 10.1007/s00269-019-01042-0

M3 - Article

AN - SCOPUS:85067406573

VL - 46

SP - 815

EP - 825

JO - Physics and Chemistry of Minerals

JF - Physics and Chemistry of Minerals

SN - 0342-1791

IS - 9

ER -

ID: 43494735