2002
DOI: 10.2138/rmg.2002.48.1
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The Crystal Structure of Apatite, Ca5(PO4)3(F,OH,Cl)

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Cited by 216 publications
(161 citation statements)
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“…To test this hypothesis, we performed ab initio computations of interfacial FAP/CAS relationships. Using the COMPASS force field package 37 , the three structures were first constructed and verified against established crystal structure lattices 38 . Various interfacial crystallographic relationships were tested, and the [100] FAP //[100] CAS gave the best interfacial lattice matching (Fig.…”
Section: Discussionmentioning
confidence: 99%
“…To test this hypothesis, we performed ab initio computations of interfacial FAP/CAS relationships. Using the COMPASS force field package 37 , the three structures were first constructed and verified against established crystal structure lattices 38 . Various interfacial crystallographic relationships were tested, and the [100] FAP //[100] CAS gave the best interfacial lattice matching (Fig.…”
Section: Discussionmentioning
confidence: 99%
“…The first migration mechanism occurs via a V Ca (1) , down the c-axis by migration between four identical sites Ca(1) ? Ca(1) ?…”
Section: Cation Migrationmentioning
confidence: 99%
“…This is due to both the thermal and chemical stability of the mineral over geological timescales and the ability of apatite mineral phases to adopt a wide range of compositions and stoichiometries [1]. This allows considerable compositional flexibility and offers the potential to dissolve and immobilise radioisotopes, in the presence of halides, which are difficult to accommodate in traditional vitreous or cement type waste forms [2].…”
Section: Introductionmentioning
confidence: 99%
“…The general formula of apatite is Ca 5 (PO 4 ) 3 (OH,F,Cl) depending on the last functional group. It is referred to as hydroxy-, fluoro-, or chloro-apatite (Hughes and Rakovan 2002). The most common gangue minerals in RPss are quartz, chert, clay, feldspar, mica, calcite, and dolomite (Heydarpoura et al 2011).…”
Section: Introductionmentioning
confidence: 99%