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Scheiner, Steve (1989) AB initio studies of the structure, energetics and vibrational spectra of hydrogen bonded systems. Journal of Molecular Structure: THEOCHEM, 202. 177-192 doi:10.1016/0166-1280(89)87015-0

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Reference TypeJournal (article/letter/editorial)
TitleAB initio studies of the structure, energetics and vibrational spectra of hydrogen bonded systems
JournalJournal of Molecular Structure: THEOCHEM
AuthorsScheiner, SteveAuthor
Year1989 (December)Volume202
PublisherElsevier BV
DOIdoi:10.1016/0166-1280(89)87015-0Search in ResearchGate
Generate Citation Formats
Mindat Ref. ID8779769Long-form Identifiermindat:1:5:8779769:7
GUID0
Full ReferenceScheiner, Steve (1989) AB initio studies of the structure, energetics and vibrational spectra of hydrogen bonded systems. Journal of Molecular Structure: THEOCHEM, 202. 177-192 doi:10.1016/0166-1280(89)87015-0
Plain TextScheiner, Steve (1989) AB initio studies of the structure, energetics and vibrational spectra of hydrogen bonded systems. Journal of Molecular Structure: THEOCHEM, 202. 177-192 doi:10.1016/0166-1280(89)87015-0
In(n.d.) Journal of Molecular Structure: THEOCHEM Vol. 202. Elsevier BV

See Also

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Scheiner, Steve (1989) Structure and energetics of weakly bound complexes: systems incorporating NH3 and PH3. Journal of Molecular Structure: THEOCHEM, 200. 117-129 doi:10.1016/0166-1280(89)85048-1
Cheam, T.C. (1992) Ab initio vibrational spectra of hydrogen-bonded N-methylacetamide. Journal of Molecular Structure: THEOCHEM, 257. 57-73 doi:10.1016/0166-1280(92)87180-8
De Almeida, W.B., Craw, J.S., Hinchliffe, Alan (1989) Ab initio vibrational spectra of HCN · HF and HF · HCN hydrogen-bonded dimers: mechanical and electrical anharmonicities. Journal of Molecular Structure: THEOCHEM, 200. 19-31 doi:10.1016/0166-1280(89)85041-9
Kutzelnigg, Werner (1989) Ab initio calculation of molecular properties. Journal of Molecular Structure: THEOCHEM, 202. 11-61 doi:10.1016/0166-1280(89)87003-4
Yeo, G.A., Ford, T.A. (1989) Ab initio molecular orbital calculations of the IR spectra of hydrogen bonded complexes of water, ammonia and hydroxylamine. Journal of Molecular Structure: THEOCHEM, 200. 507-532 doi:10.1016/0166-1280(89)85075-4
Karpfen, Alfred, Kurnig, Ingrid J., Lischka, Hans (1991) Ab initio studies on hydrogen-bonded trimers: structure and vibrational spectra of HCN(HF)2 and (HCN)2HF. Journal of Molecular Structure: THEOCHEM, 227. 337-350 doi:10.1016/0166-1280(91)85297-k
Latajka, Z., Ratajczak, H., Zeegers-Huyskens, Th., Scheiner, S. (1991) Ab initio studies of hydrogen-bonded complexes between uracil and HCl. Journal of Molecular Structure: THEOCHEM, 235. 409-415 doi:10.1016/0166-1280(91)85114-m
Scheiner, Steve (1992) On the underlying source of energetics of bending of hydrogen bonds. Journal of Molecular Structure: THEOCHEM, 256. 1-16 doi:10.1016/0166-1280(92)87154-r
Lowrey, Alfred H. (1989) AB initio investigations of symmetric rotor models for small trifluoromethyl substituted molecules. Journal of Molecular Structure: THEOCHEM, 187. 177-190 doi:10.1016/0166-1280(89)85159-0
Remko, Milan, Scheiner, Steve (1990) Ab initio investigations of the hydrolysis of the carbamate bond. Journal of Molecular Structure: THEOCHEM, 204. 331-335 doi:10.1016/0166-1280(90)85084-z
Karpfen, A., Yanovitskii, O. (1994) Structure and vibrational spectra of neutral, protonated and deprotonated hydrogen bonded polymers: an ab initio SCF study on chain-like hydrogen fluoride clusters. Journal of Molecular Structure: THEOCHEM, 307. 81-97 doi:10.1016/0166-1280(94)80120-7
 
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