IUCr XVII Abstract Listing for session 21.02

Session Chair: Carlo Gatti
Centro per lo Studio delle Relaziioni
tra Struttura e Reattivita' Chimica
Universita degli Studi di Milano
Via Golgi 19
20133 Milano
Italy
Phone: 39 2 26603 277
Fax: 39 2 70638129

Program Contact: C. Johnson
Chemistry Division
Oak Ridge National Lab
Bldg 4500N MS-6197
Oak Ridge TN 37831-6197
FAX 615 576 5235
ckj@ornl.gov

(E1095) MS21.02.01
Date: Wednesday, August 14, Time: 03:35 - 04:03, Room: 612
CRITICAL POINT ANALYSIS IN PROTEIN ELECTRON DENSITY MAP INTERPRETATION
Susan Fortier , Antony Chiverton, Janice Glasgow and Lawrence Leherte
fortiers@post.queensu.ca

(E0651) MS21.02.02
Date: Wednesday, August 14, Time: 04:03 - 04:31, Room: 612
THE MEASUREMENT AND USE OF TOPOLOGICAL FEATURES OF THE EXPERIMENTAL ELECTRON DENSITY
V.G. Tsirelson
tsirelso@mhti.msk.su

(S0663) MS21.02.03
Date: Wednesday, August 14, Time: 04:31 - 04:59, Room: 612
EXPERIMENTAL DETERMINATION OF TOPOLOGICAL FEATURES IN METALS AND INORGANIC MATERIALS
B.B. Iversen and F. Krebs Larsen
bo@kemi.aau.dk

(E1426) MS21.02.04
Date: Wednesday, August 14, Time: 04:59 - 05:27, Room: 612
TOPOLOGY AND QUANTUM THEORY OF ATOMS IN MOLECULES AND CRYSTALS
R.F.W. Bader

(E0964) MS21.02.05
Date: Wednesday, August 14, Time: 05:27 - 05:43, Room: 612
AN EFFICIENT LOCAL ANALYTIC REPRESENTATION OF ELECTRON DENSITY MAPS: THE SPECTRAL SPLINE APPROXIMATION
Erik Nelson and Lynn Ten Eyck
enelson@sdsc.edu

(S0501) MS21.02.06
Date: Wednesday, August 14, Time: 05:43 - 05:59, Room: 612
TRANSFERABILITY AS A PRINCIPLE IN CHEMISTRY- THE CHARGE DENSITY OF CH3NH3+ IN TWO SALTS
Dennis Madsen , Claus Flensburg and Sine Larsen
dennis@x-ray.ki.ku.dk

(D0144) PS21.02.07
Session: III, Board: 361, Room: Not Yet Assigned
TOPOND : A PROGRAM FOR THE APPLICATION OF THE QUANTUM THEORY OF ATOMS IN MOLECULES TO PERIODIC SYSTEMS
Carlo Gatti
gamess@rs5.csrsrc.mi.cnr.it

(E0904) PS21.02.08
Session: III, Board: 362, Room: Not Yet Assigned
A TOPOLOGICAL ANALYSIS OF CHARGE DENSITIES OF THE DIAMOND, SILICON AND GERMANIUM CRYSTALS
Yuri A. Abramov
abramov@mhti.msk.su

(E1502) PS21.02.09
Session: III, Board: 363, Room: Not Yet Assigned
DETERMINATION OF ZERO-FLUX SURFACES AND INTERGRATED PROPERTIES FROM EXPERIMENTALLY DETERMINED CHARGE DENSITIES IN CRYSTALS
C. Flensburg , D. Madsen, S. Larsen and R.F. Stewart
claus@xray.ki.ku.dk

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