The determination of minima and saddle points on the potential energy surfaces of the hydrogen bonded species 02-HF and 0,-H20 is performed with unrestricted Hartree-Fock calculations. Geometries, electron density distributions, and relative energies for every stationary point are reported. Only one
β¦ LIBER β¦
Zero Point Energy and Physical Properties of H2O and D2O
β Scribed by BERNAL, J. D.; TAMM, G.
- Book ID
- 109509618
- Publisher
- Nature Publishing Group
- Year
- 1935
- Tongue
- English
- Weight
- 231 KB
- Volume
- 135
- Category
- Article
- ISSN
- 0028-0836
- DOI
- 10.1038/135229b0
No coin nor oath required. For personal study only.
π SIMILAR VOLUMES
Stationary points on the potential energ
β
Jesus P. Lopez
π
Article
π
1989
π
John Wiley and Sons
π
English
β 674 KB
Dielectric and structural properties of
β
P. S. Yastremskii
π
Article
π
1971
π
SP MAIK Nauka/Interperiodica
π
English
β 126 KB
The overtone spectra of H2O, D2O and mix
β
D. Kroh; A. Ron
π
Article
π
1975
π
Elsevier Science
π
English
β 365 KB
Anomalous H+ and D+ conductance in H2OβD
β
WeingΓ€rtner, H.; Chatzidimttriou-Dreismann, C. A.
π
Article
π
1990
π
Nature Publishing Group
π
English
β 360 KB
Stimulated Raman spectra from H2O, D2O,
π
Article
π
1970
π
Elsevier Science
π
English
β 49 KB
The results are especially encouraging in the light of Konowalov's calculation [8]. He found that Hulth&n functions (integral transforms of 1s functions), which are somewhat better than k,(q) in the Z-electron+atomic case, reduce to scaled 1s functions in H2, except for larger R values. Since k, (v)
Stimulated raman spectra from H2O, D2O,
β
M.J. Colles; G.E. Walrafen; K.W. Wecht
π
Article
π
1970
π
Elsevier Science
π
English
β 489 KB