Low-frequency vibrational modes and temperature dependence of NQR frequencies in 1,2,4,5-tetrabromobenzene

1984 ◽  
Vol 22 (1) ◽  
pp. 1-5 ◽  
Author(s):  
N. Bharateswara Rao ◽  
M. Rangacharyulu ◽  
P. Venkatacharyulu ◽  
D. Premaswarup
Keyword(s):  
Temperature Dependence ◽  
Low Frequency ◽  
Vibrational Modes

Temperature Dependence of the Air/Water Interface Revealed by Polarization Sensitive Sum-Frequency Generation Spectroscopy

2018 ◽  
Author(s):  
Daniel R. Moberg ◽  
Shelby C. Straight ◽  
Francesco Paesani
Keyword(s):  
Temperature Dependence ◽  
Low Frequency ◽  
Potential Energy Function ◽  
Md Simulations ◽  
Sum Frequency Generation ◽  
Water Molecules ◽  
Water Interface ◽  
Sum Frequency ◽  
Air Water Interface ◽  
Frequency Generation

<div> <div> <div> <p>The temperature dependence of the vibrational sum-frequency generation (vSFG) spectra of the the air/water interface is investigated using many-body molecular dynamics (MB-MD) simulations performed with the MB-pol potential energy function. The total vSFG spectra calculated for different polarization combinations are then analyzed in terms of molecular auto-correlation and cross-correlation contributions. To provide molecular-level insights into interfacial hydrogen-bonding topologies, which give rise to specific spectroscopic features, the vSFG spectra are further investigated by separating contributions associated with water molecules donating 0, 1, or 2 hydrogen bonds to neighboring water molecules. This analysis suggests that the low frequency shoulder of the free OH peak which appears at ∼3600 cm−1 is primarily due to intermolecular couplings between both singly and doubly hydrogen-bonded molecules. </p> </div> </div> </div>

scholarly journals Low frequency vibrational modes of oxygenated myoglobin, hemoglobins, and modified derivatives.

1994 ◽  
Vol 269 (49) ◽  
pp. 31047-31050
Author(s):  
S Jeyarajah ◽  
L M Proniewicz ◽  
H Bronder ◽  
J R Kincaid
Keyword(s):  
Low Frequency ◽  
Vibrational Modes

scholarly journals Moduli and modes in the Mikado model

Soft Matter ◽  
2021 ◽  
Author(s):  
Brian Tighe ◽  
Karsten Baumgarten
Keyword(s):  
Shear Modulus ◽  
Mechanical Model ◽  
Low Frequency ◽  
Vibrational Modes ◽  
Prior Work ◽  
Fiber Networks ◽  
Elastic Shear Modulus ◽  
Flexible Fiber ◽  
Elastic Shear

We determine how low frequency vibrational modes control the elastic shear modulus of Mikado networks, a minimal mechanical model for semi-flexible fiber networks. From prior work it is known that...

Temperature dependence of the low-frequency surface impedance of metals near the extreme anomalous limit

1978 ◽  
Vol 17 (4) ◽  
pp. 1721-1737 ◽  
Author(s):  
A. Manz ◽  
J. Black ◽  
Kh. Pashaev ◽  
D. L. Mills
Keyword(s):  
Temperature Dependence ◽  
Surface Impedance ◽  
Low Frequency

Temperature dependence of low-frequency optical phonons in TlInS2

2015 ◽  
Vol 12 (6) ◽  
pp. 826-829 ◽  
Author(s):  
Raul Paucar ◽  
YongGu Shim ◽  
Kazuki Wakita ◽  
Oktay Alekperov ◽  
Nazim Mamedov
Keyword(s):  
Temperature Dependence ◽  
Low Frequency ◽  
Optical Phonons

Temperature dependence of the normal vibrational modes of hcp Zr

1978 ◽  
Vol 18 (6) ◽  
pp. 2632-2642 ◽  
Author(s):  
C. Stassis ◽  
J. Zarestky ◽  
D. Arch ◽  
O. D. McMasters ◽  
B. N. Harmon
Keyword(s):  
Temperature Dependence ◽  
Vibrational Modes ◽  
Normal Vibrational Modes

Interaction of Point Defects in Ice

1978 ◽  
Vol 21 (85) ◽  
pp. 115-122
Author(s):  
J. H. Bilgram ◽  
H. Gränicher
Keyword(s):  
Experimental Data ◽  
Dielectric Properties ◽  
Temperature Dependence ◽  
Point Defects ◽  
Low Frequency ◽  
Defect Concentration ◽  
Dielectric Measurements ◽  
Long Time ◽  
Nmr Techniques ◽  
Bjerrum Defect

AbstractThe interaction of point detects in ice has been neglected for a long time. Experimental data obtained from dielectric measurements on HF-doped crystals stimulated a new evaluation of the possibility of an interaction between Bjerrum defects and ions. In a previous paper it has been shown that this leads us to assume the existence of aggregates of Bjerrum defects and ions. In this paper these aggregates and Bjerrum defects are used to explain the dielectric properties of ice, especially the temperature dependence of the product of the high and low frequency conductivity σ0σ∞.The interaction of Bjerrum defects and impurity molecules leads to a dependence of the concentration of frenkel pairs on Bjerrum-defect concentration. At HF concentrations above the native Bjerrum-defect concentration the formation of a Frenkel pair is enhanced. This leads to the fast out-diffusion which has been studied in highly doped crystals by means of NMR techniques.

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