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O-H BONDS IN ELECTRIC-FIELDS - ELECTRON-DENSITIES AND VIBRATIONAL FREQUENCY-SHIFTS
Uppsala University.
1995 (English)In: CHEMICAL PHYSICS LETTERS, Vol. 233, no 4, 376-382 p.Other (Other scientific)
Abstract [en]

The changes in the electron density distribution caused by varying the O-H bond length for HDO and OH- in uniform electric fields are investigated and related to the frequency shifts for the uncoupled O-H stretching vibration. Numerical integration of di

Place, publisher, year, pages
ELSEVIER SCIENCE BV , 1995. Vol. 233, no 4, 376-382 p.
Keyword [en]
ABINITIO CALCULATIONS; WATER; MOLECULE; CLUSTER
Identifiers
URN: urn:nbn:se:uu:diva-69179OAI: oai:DiVA.org:uu-69179DiVA: diva2:97090
Note
Addresses: HERMANSSON K, UNIV UPPSALA, DEPT CHEM, BOX 531, S-75121 UPPSALA, SWEDEN.Available from: 2008-10-17 Created: 2008-10-17

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