Electron Density and Chemical Bonding II

Electron Density and Chemical Bonding II

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T. Koritsanszky, A. Volkov, M. Chodkiewicz: New Directions in Pseudoatom-Based X-Ray Charge Density Analysis.- B. Dittrich, D. Jayatilaka: Reliable Measurements of Dipole Moments from Single-Crystal Diffraction Data and Assessment of an In-Crystal Enhancement.- B. Engels, Th. C. Schmidt, C. Gatti, T. Schirmeister, R.F. Fink: Challenging Problems in Charge Density Determination: Polar Bonds and Influence of the Environment.- S. Fux, M. Reiher: Electron Density in Quantum Theory.- K. Meindl, J.Henn: Residual Density Analysis.- C. Gatti: The Source Function Descriptor as a Tool to Extract Chemical Information from Theoretical and Experimental Electron Densities.Volkov A, Abramov YA, Coppens P (2001) Density optimized radial exponents for X-ray charge density refinement from ab initio calculations. ... Usera#39;s manual. http: //xd.chem.buffalo.edu/docs/xdmanual. pdf MAcller C, Plesset MS (1934) Note on an approximation treatment for ... Trucks GW, Schlegel HB, Scuseria GE, Robb MA, Cheeseman JR, Montgomery JA Jr, Vreven T, Kudin KN, Burant JC, Millam JM, anbsp;...

Title:Electron Density and Chemical Bonding II
Author:Dietmar Stalke
Publisher:Springer - 2012-06-05


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