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- Kanai, M, et al.
(författare)
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- 2023
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swepub:Mat__t
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2. |
- Niemi, MEK, et al.
(författare)
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- 2021
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swepub:Mat__t
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3. |
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4. |
- Purton, J., et al.
(författare)
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LDF pseudopotential calculations of the α-quartz structure and hydrogarnet defect
- 1992
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Ingår i: Physics and chemistry of minerals. - 0342-1791 .- 1432-2021. ; 18:6, s. 389-392
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Tidskriftsartikel (refereegranskat)abstract
- Ab initio LDF theory has been used to study the structure of the hydrogarnet defect in α-quartz. The predicted structure is in good agreement with the available sexperimental data. The techniques employed also yield a good model for the structure of α-quartz, giving an average Si-O bond length of 1.62 Å and average Si-O-Si angle of 142°.
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