High pressure and temperature effects on the molecular crystal 2-amino-5-methyl-1,3,4-thiadiazole

2018 ◽  
Vol 49 (10) ◽  
pp. 1713-1721 ◽  
Author(s):  
Thiago A. de Toledo ◽  
Ricardo R. F. Bento ◽  
Thiago R. Cunha ◽  
Paulo S. Pizani
2015 ◽  
Vol 33 (3) ◽  
pp. 649-659 ◽  
Author(s):  
Kada Bidai ◽  
Mohammed Ameri ◽  
Djillali Bensaid ◽  
Nour-Eddine Moulay ◽  
Y. Al-Douri ◽  
...  

Abstract Structural, elastic and thermodynamic properties of sodium chalcogenides (Na2X, X = S, Se) have been calculated using FP-APW+1o method. The ground state lattice parameter, bulk moduli have been obtained. The Zener anisotropy factor, Poisson’s ratio, shear modulus, Young’s modulus, have also been calculated. The calculated structural and elastic constants are in good agreement with the available data. We also determined the thermodynamic properties, such as heat capacities CV and CP, thermal expansion α , entropy S, and Debye temperature θD, at various pressures and temperatures for Na2X compounds. The elastic constants under high pressure and temperature are also calculated and elaborated.


2020 ◽  
Vol 5 (8) ◽  
pp. 1484-1500 ◽  
Author(s):  
Kavimonica Venkatesan ◽  
Francis Prashanth ◽  
Vinay Kaushik ◽  
Harshavardhan Choudhari ◽  
Dhairya Mehta ◽  
...  

Kinetics and product distribution from high pressure hydropyrolysis of biomass using Py-GC/MS and Py-FTIR.


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