منابع مشابه
Momentum Distribution and Charge Density in Solid-State Theory *
We present a discussion of a number of conceptual and methodological aspects associated with the theoretical characterization and computat ion of charge densities and momentum distributions in solids. The main ambition has been to stress properties that both exact and approximate quantities must possess. We have also attempted to point out conceptual and computat ional trends which would seem t...
متن کاملCharge Density
Low-temperature single-crystal neutron and X-ray diffraction data were collected for bullvalene (Figure 1). X —N Fourier and multipole static deformation electron density maps were calculated and compared. Atomic mean-square-displacement parameters were analysed in the framework of the rigid-body motion model and the residual amplitudes (UOBS — t/TLS) were graphically interpreted. The prelimina...
متن کاملcharge density.
We study the Euclidean two-point correlation function Gq(x) of the topological charge density in QCD. A general statement based on reflection positivity tells us that Gq(x) < 0 for x 6= 0. On the other hand the topological susceptibility χq = ∫ dxGq(x) is a positive quantity. This indicates that Gq(x) developes a positive contact term at x = 0, that contributes to the determination of the physi...
متن کاملChiral charge-density waves.
We discovered the chirality of charge-density waves (CDW) in 1T-TiSe₂ by using STM and time-domain optical polarimetry. We found that the CDW intensity becomes Ia₁∶Ia₂∶Ia₃ = 1∶0.7 ± 0.1∶0.5 ± 0.1, where Ia(i) (i=1,2,3) is the amplitude of the tunneling current contributed by the CDWs. There were two states, in which the three intensity peaks of the CDW decrease clockwise and anticlockwise. The ...
متن کاملA Theoretical Charge Density Investigation on Histidine-Histidine Dipeptide in Gas Phase
In the present work, an extensive theoretical calculation study on Histidine-Histidine dipeptide in gas phase is done by using DFT method with Gaussian 98 program. Through investigations on the molecular geometries of this molecule it is found that there is six rings in the molecules not two rings. The presence of four intramolecular hydrogen bonds is responsible for the formation of additional...
متن کاملذخیره در منابع من
با ذخیره ی این منبع در منابع من، دسترسی به آن را برای استفاده های بعدی آسان تر کنید
ژورنال
عنوان ژورنال: Acta Crystallographica Section A Foundations of Crystallography
سال: 1996
ISSN: 0108-7673
DOI: 10.1107/s0108767396085340