CHARGE DENSITY ANALYSIS INTO THE 21ST CENTURY

Lectures

Regency Ballroom A (RA)

Monday, July 21




08:30 - 08:45 AM
Introductory Remarks. F. Ross, Presiding.

08:45 - 09:30 AM MoA01
(E434)
Edwin D. Stevens. Invited Lecture.
Formalisms and Applications of Charge Density Analysis for the 21st Century.

09:30 - 10:15 AM MoA02
(E170)
Philip Coppens. Invited Lecture.
What Equipment Do We Need for Future Charge Density Studies?

10:15 - 10:35 AM
Coffee Break.

10:35 - 11:00 AM MOA03
(E476)
Claus Flensburg.
Comparison of Topological Properties from Theoretical and Experimental Charge Densities.
et al: Carlo Gatti.

11:00 - 11:25 AM MoA04
(E335)
Jacek Zaleski.
Analysis of an Extensive Imaging-Plate Data Set on Cr(NH3)6Cr(CN)6, Collected with 0.394 Synchrotron Radiation.
et al: R. Bolotovsky, P. Coppens.

11:25 - 11:50 AM MoA05
(E414)
Dennis Madsen.
Properties of the Crystal Electron Density of Methylammonium Deuterium Maleate.
et al: Claus Flensburg, Sine Larsen.

02:00 - 02:05 PM
Afternoon Introduction. E. Stevens, Presiding.

02:05 - 02:50 PM MoA06
(E094)
Tibor Koritsanszky. Invited Lecture.
Advanced Multipole Refinements.

02:50 - 03:35 PM MoA07
(E119)
C. Jelsch. Invited Lecture.
Multipole X-Ray Refinement of Peptides and Proteins.
et al: C. Lecomte, V. Pichon, A. Aubry.

03:35 - 04:00 PM
Coffee Break.

04:00 - 04:25 PM MoA08
(E377)
Zhengwei Su.
Nonlinear Least-Squares Fitting of Numerical Relativistic Atomic Wave Functions by a Linear Combination of Slater-Type Functions for Atoms Z =1-54.
et al: Philip Coppens.

04:25 - 05:00 PM MoA09
(E152)
Yuri A. Abramov.
Secondary Interactions and Bond Critical Points in the Ionic Crystals.

05:00 - 05:25 PM MoA10
(E430)
T. S. Cameron.
Deformation Densities in Hydrogen Bonds to Aromatic Pi Systems.
et al: W. Kwaitkowski, K. N. Robertson, O. Knop.


Contact: aca-inquiries@hwi.buffalo.edu

Last updated: Tue Jun 24 16:07:52 EDT 1997