Ab initio chemical kinetics for the ClOO + NO reaction: Effects of temperature and pressure on product branching formation

2012 ◽  
Vol 137 (1) ◽  
pp. 014315 ◽  
Author(s):  
P. Raghunath ◽  
M. C. Lin
Keyword(s):  
Ab Initio ◽  
Chemical Kinetics ◽  
Effects Of Temperature ◽  
Temperature And Pressure ◽  
Product Branching

scholarly journals Effects of temperature and pressure on the optical and vibrational properties of thermoelectric SnSe

2019 ◽  
Vol 21 (17) ◽  
pp. 8663-8678 ◽  
Author(s):  
Ilias Efthimiopoulos ◽  
Matthias Berg ◽  
Annika Bande ◽  
Ljiljana Puskar ◽  
Eglof Ritter ◽  
...  
Keyword(s):  
Ab Initio ◽  
Vibrational Properties ◽  
Comprehensive Investigation ◽  
Effects Of Temperature ◽  
Temperature And Pressure

We have conducted a comprehensive investigation of the optical and vibrational properties of the binary semiconductor SnSe as a function of temperature and pressure by means of experimental and ab initio probes.

Palladium-catalyzed carbonylation of 1,5-cyclooctadiene. Effects of temperature and pressure

1991 ◽  
Vol 56 (3) ◽  
pp. 663-672 ◽  
Author(s):  
Curtis B. Anderson ◽  
Rade Marković
Keyword(s):  
Carbon Monoxide ◽  
Oxidative Carbonylation ◽  
Influence Of Temperature ◽  
Carbonylation Reaction ◽  
Palladium Catalyzed ◽  
Effects Of Temperature ◽  
Temperature And Pressure

The influence of temperature and carbon monoxide pressure on the course of oxidative carbonylation reaction of 1,5-cyclooctadiene in the presence of the palladium(II) salts as a catalyst, was investigated.

Ab initio rate coefficients for reactions of 2,5-dimethylhexyl isomers with O2: temperature- and pressure-dependent branching ratios

2021 ◽  
Vol 23 (10) ◽  
pp. 6225-6240
Author(s):  
Mohamad Akbar Ali
Keyword(s):  
Ab Initio ◽  
Branching Ratios ◽  
Rate Coefficients ◽  
Temperature And Pressure

Pressures-dependence rate coefficients for the formation 2,2,5,5-tetramethyl-tetrahydrofuran.

scholarly journals Effects of temperature and pressure on the glass transitions of plastic bonded explosives

2000 ◽  
Vol 357-358 ◽  
pp. 89-95 ◽  
Author(s):  
Mary Stinecipher Campbell ◽  
Danielle Garcia ◽  
Deanne Idar
Keyword(s):  
Glass Transitions ◽  
Effects Of Temperature ◽  
Temperature And Pressure

scholarly journals Effects of Temperature and Pressure on Sulfate Reduction and Anaerobic Oxidation of Methane in Hydrothermal Sediments of Guaymas Basin

2004 ◽  
Vol 70 (2) ◽  
pp. 1231-1233 ◽  
Author(s):  
Jens Kallmeyer ◽  
Antje Boetius
Keyword(s):  
Sulfate Reduction ◽  
Deep Sea ◽  
Anaerobic Oxidation Of Methane ◽  
Anaerobic Oxidation ◽  
Guaymas Basin ◽  
Oxidation Of Methane ◽  
Hydrothermal Sediments ◽  
Deep Sea Sediments ◽  
Effects Of Temperature ◽  
Temperature And Pressure

ABSTRACT Rates of sulfate reduction (SR) and anaerobic oxidation of methane (AOM) in hydrothermal deep-sea sediments from Guaymas Basin were measured at temperatures of 5 to 200°C and pressures of 1 × 105, 2.2 × 107, and 4.5 × 107 Pa. A maximum SR of several micromoles per cubic centimeter per day was found at between 60 and 95°C and 2.2 × 107 and 4.5 × 107 Pa. Maximal AOM was observed at 35 to 90°C but generally accounted for less than 5% of SR.

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