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Medientyp:
Buch
Titel:
Modern charge-density analysis
Enthält:
A guided tour through modern charge density analysis
/ Carlo Gatti and Piero MacchiElectron densities and related properties from the ab-initio simulation of crystalline solids / Cesare Pisani ... [et al.]
Modeling and analysing thermal motion in experimental charge density studies
/ Anders Ø. Madsen
Spin and the complementary worlds of electron position and momentum densities
/ Jonathan A. Duffy and Malcom J. Cooper
Past, present and future of charge density and density matrix refinements
/ Jean-Michel Gillet and Tibor Koritsanszky
Using wavefunctions to get more information out of diffraction experiments
/ Dylan Jayatilaka
Local models for joint position and momentum density studies
/ Jean-Michel Gillet
Magnetization densities in material science
/ Béatrice Gillon and Pierre Becker
Beyond standard charge density topological analyses
/ Angel Martín Pendás ... [et al.]
On the interplay between real and reciprocal space properties
/ Wolfgang Scherer ... [et al.]
Intermolecular interaction energies from experimental charge density studies
/ Paulina M. Dominiak, Enrique Espinosa and János G. Ángyán
Chemical information from charge density studies
/ Ulrike Flierler, Dietmar Stalke and Louis J. Farrugia
Charge density in materials and energy science
/ Jacob Overgaard ... [et al.]
A generic force field based on quantum chemical topology
/ Paul L. A. Popelier
Frontier applications of experimental charge density and electrostatics to bio-macromolecules
/ Christian Jelsch ... [et al.]
Charge densities and crystal engineering
/ Mark A. Spackman
Electron density topology of crystalline solids at high pressure
/ John S. Tse and Elena V. Boldyreva
Bonding changes along solid-solid phase transitions using the electron localization function approach
/ Julia Contreras-Garcia ... [et al.]
Multi-temperature electron density studies
/ Riccardo Destro ... [et al.]
Transient charge density maps from femtosecond X-ray diffraction
/ Thomas Elsaesser and Michael Woerner
Charge density and chemical reactions: a unified view from conceptual DFT
/ Paul A. Johnson ... [et al.].