Article ID | Journal | Published Year | Pages | File Type |
---|---|---|---|---|
5383978 | Chemical Physics Letters | 2011 | 5 Pages |
Abstract
⺠Theoretical infrared spectra of ammonia-hydrogen halide complexes from CPMD. ⺠Experimental gas phase spectrum not yet reported. ⺠Proton stretching frequencies lower than previously reported. ⺠Important role of out of plane hydrogen bond bending in proton transfer.
Related Topics
Physical Sciences and Engineering
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Physical and Theoretical Chemistry
Authors
PaweÅ Panek, Malgorzata Biczysko, ZdzisÅaw Latajka,