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.

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8 results for H. Kistenmacher

Study of the structure of molecular complexes. V. Heat of formation for the Li⁺, Na⁺, K⁺, F^-, and Cl ^- ion complexes with a single water molecule
- - H. Kistenmacher
  - H. Popkie
  - et al.
- 2003
- The Journal of Chemical Physics
Study of the structure of molecular complexes. IV. the Hartree-Fock potential for the water dimer and its application to the liquid state
- - H. Popkie
  - H. Kistenmacher
  - et al.
- 2003
- The Journal of Chemical Physics
Study of the electronic structure of molecules. XVIII. Interaction between a lithium atom and a cyano group as an example of a polytopic bond
- - E. Clementi
  - H. Kistenmacher
  - et al.
- 2003
- The Journal of Chemical Physics
Study of the structure of molecular complexes. III. Energy surface of a water molecule in the field of a fluorine or chlorine anion
- - H. Kistenmacher
  - H. Popkie
  - et al.
- 2003
- The Journal of Chemical Physics
Study of the structure of molecular complexes. VI. Dimers and small clusters of water molecules in the Hartree-Fock approximation
- - H. Kistenmacher
  - G.C. Lie
  - et al.
- 2003
- The Journal of Chemical Physics
Study of the structure of molecular complexes. VII. Effect of correlation energy corrections to the Hartree-Fock water-water potential on Monte Carlo simulations of liquid water
- - H. Kistenmacher
  - H. Popkie
  - et al.
- 2003
- The Journal of Chemical Physics
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
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