Study of the structure of molecular complexes. VIII. Small clusters of water molecules surrounding Li+, Na+, K+, F-, and Cl- ions
- H. Kistenmacher
- H. Popkie
- et al.
- 2003
- The Journal of Chemical Physics
Publications
This is our catalog of publications authored by IBM researchers, in collaboration with the global research community. It’s an ever-growing body of work that shows why IBM is one of the most important contributors to modern computing.
Date
Featured collections
Popular topics
59 results for Enrico Clementi
Study of the electronic structure of molecules XXII. Additional ab initio computations for the barrier to internal rotation in polynucleotide chains
- George C. Lie
- Enrico Clementi
- 2003
- The Journal of Chemical Physics
Analytical Hartree-Fock functions for positive ions from lithium to xenon
- Carla Roetti
- Enrico Clementi
- 2003
- The Journal of Chemical Physics
A theoretical study of the lithium fluoride molecule in water
- R.O. Watts
- E. Clementi
- et al.
- 2003
- The Journal of Chemical Physics
Analytical Hartree-Fock wavefunctions for the neutral atoms from helium to xenon
- Carla Roetti
- Enrico Clementi
- 2003
- The Journal of Chemical Physics
On the SCF-LCAO-MO and the SCF-Xa-SW approximations: Computation of the barrier to internal rotation for ethane
- E. Clementi
- H. Kistenmacher
- et al.
- 2003
- The Journal of Chemical Physics
Electronic structure in aromatic compounds
- Enrico Clementi
- 2002
- Chemical Reviews
Hydrogen bonding and the Compton profile of water
- M.H. Whangbo
- V.H. Smith Jr
- et al.
- 2001
- Journal of Physics B: Atomic and Molecular Physics
Electronic and vibrational properties of C60 at finite temperature from ab initio molecular dynamics
- Bradley P. Feuston
- Wanda Andreoni
- et al.
- 1991
- Physical Review B
Correlation energies in the isoelectronic series of He, Li, Be and Ne
- Antonio Rizzo
- Enrico Clementi
- et al.
- 1991
- Chemical Physics Letters