Experimental and Theoretical Studies of the Unimolecular Decomposition of Nitrosobenzene:  High-Pressure Rate Constants and the C−N Bond Strength

1997 ◽  
Vol 101 (34) ◽  
pp. 6043-6047 ◽  
Author(s):  
J. Park ◽  
I. V. Dyakov ◽  
A. M. Mebel ◽  
M. C. Lin
Keyword(s):  
High Pressure ◽  
Bond Strength ◽  
Rate Constants ◽  
Theoretical Studies ◽  
Unimolecular Decomposition ◽  
Experimental And Theoretical Studies

scholarly journals Experimental and Theoretical Studies on α-In2Se3 at High Pressure

2018 ◽  
Vol 57 (14) ◽  
pp. 8241-8252 ◽  
Author(s):  
Rosario Vilaplana ◽  
Samuel Gallego Parra ◽  
Alejandro Jorge-Montero ◽  
Plácida Rodríguez-Hernández ◽  
Alfonso Munoz ◽  
...  
Keyword(s):  
High Pressure ◽  
Theoretical Studies ◽  
Experimental And Theoretical Studies

The H + HeH+ → He + H2+ reaction from the ultra-cold regime to the three-body breakup: exact quantum mechanical integral cross sections and rate constants

2014 ◽  
Vol 16 (23) ◽  
pp. 11662-11672 ◽  
Author(s):  
Dario De Fazio
Keyword(s):  
Cross Sections ◽  
Rate Constants ◽  
Quantum Mechanical ◽  
Theoretical Studies ◽  
Quantum Mechanical Calculations ◽  
Exact Quantum ◽  
Three Body ◽  
Experimental And Theoretical Studies

Benchmark quantum mechanical calculations from the Wigner's regime to the three-body breakup are compared to previous experimental and theoretical studies.

scholarly journals Experimental evidence for the existence of a second partially-ordered phase of ice VI

2021 ◽  
Vol 12 (1) ◽  
Author(s):  
Ryo Yamane ◽  
Kazuki Komatsu ◽  
Jun Gouchi ◽  
Yoshiya Uwatoko ◽  
Shinichi Machida ◽  
...  
Keyword(s):  
Phase Diagram ◽  
High Pressure ◽  
Research Approach ◽  
Theoretical Studies ◽  
Partially Ordered ◽  
Structural Variety ◽  
Ordered Phases ◽  
New Form ◽  
Experimental And Theoretical Studies ◽  
Pressure Phase

AbstractIce exhibits extraordinary structural variety in its polymorphic structures. The existence of a new form of diversity in ice polymorphism has recently been debated in both experimental and theoretical studies, questioning whether hydrogen-disordered ice can transform into multiple hydrogen-ordered phases, contrary to the known one-to-one correspondence between disordered ice and its ordered phase. Here, we report a high-pressure phase, ice XIX, which is a second hydrogen-partially-ordered phase of ice VI. We demonstrate that disordered ice undergoes different manners of hydrogen ordering, which are thermodynamically controlled by pressure in the case of ice VI. Such multiplicity can appear in all disordered ice, and it widely provides a research approach to deepen our knowledge, for example of the crucial issues of ice: the centrosymmetry of hydrogen-ordered configurations and potentially induced (anti-)ferroelectricity. Ultimately, this research opens up the possibility of completing the phase diagram of ice.

scholarly journals Crystal structure and transporting properties of Bi2S3 under high pressure: Experimental and theoretical studies

2016 ◽  
Vol 688 ◽  
pp. 329-335 ◽  
Author(s):  
Chunyu Li ◽  
Jinggeng Zhao ◽  
Qingyang Hu ◽  
Zhiguo Liu ◽  
Zhenhai Yu ◽  
...  
Keyword(s):  
Crystal Structure ◽  
High Pressure ◽  
Theoretical Studies ◽  
Experimental And Theoretical Studies
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