Ab initio modelling of calcium phosphate clusters and their vibrational spectra
Calcium phosphate and hydroxylcalcium phosphate clusters that model amorphous phase elementary unit
 cells as well as their vibrational spectra were calculated by ab initio quantum chemical method using GAMESS
 code. Normal coordinate analysis was accomplished for phosphate anion, tr...
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| Published in: | Condensed Matter Physics |
|---|---|
| Date: | 2006 |
| Main Authors: | , , , |
| Format: | Article |
| Language: | English |
| Published: |
Інститут фізики конденсованих систем НАН України
2006
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| Online Access: | https://nasplib.isofts.kiev.ua/handle/123456789/121443 |
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| Journal Title: | Digital Library of Periodicals of National Academy of Sciences of Ukraine |
| Cite this: | Ab initio modelling of calcium phosphate clusters and
 their vibrational spectra / I.E. Boldeskul, L.F. Sukhodub, A.N. Kalinkevich, V.D. Khavryutchenko // Condensed Matter Physics. — 2006. — Т. 9, № 4(48). — С. 669–679. — Бібліогр.: 15 назв. — англ. |