Matches in SemOpenAlex for { <https://semopenalex.org/work/W2031736349> ?p ?o ?g. }
- W2031736349 abstract "The initial state selected time-dependent wave packet method was employed to calculate the integral cross sections for the H(2) + D(2) reaction with and without the centrifugal sudden (CS) approximation by including all important K (the projection of the total angular momentum on the body-fixed axis) blocks. With a full-dimensional model, the first fully converged coupled-channel (CC) cross sections for different competitive processes from the ground rotational state were obtained: collision induced dissociation (CID), four-center (4C) reaction and single exchange (SE) reaction. The effect of the total angular momentum J on the reaction dynamics of H(2) + D(2) and the accuracy of the CS approximation have also been studied. It was found that the CID and SE processes occur in a wide range of J values while the 4C process can only take place in a narrow window of J values. For this reason, the CC cross section for the 4C channel is merely comparable to the SE channel. A comparison of the integral cross sections from CC and CS calculations showed that the CS approximation works well for the CID process but not for the 4C and SE processes, and the discrepancy between the CC and CS cross sections grows larger as the translational energy and/or the vibrational energy increase(s)." @default.
- W2031736349 created "2016-06-24" @default.
- W2031736349 creator A5032963653 @default.
- W2031736349 creator A5062129951 @default.
- W2031736349 creator A5078424123 @default.
- W2031736349 date "2012-03-16" @default.
- W2031736349 modified "2023-10-06" @default.
- W2031736349 title "Fully converged integral cross sections of collision induced dissociation, four-center, and single exchange reactions, and accuracy of the centrifugal sudden approximation in H2 + D2 reaction" @default.
- W2031736349 cites W1485478115 @default.
- W2031736349 cites W1504924449 @default.
- W2031736349 cites W1535938854 @default.
- W2031736349 cites W1565097843 @default.
- W2031736349 cites W1582697914 @default.
- W2031736349 cites W1597170587 @default.
- W2031736349 cites W1620584916 @default.
- W2031736349 cites W1657020830 @default.
- W2031736349 cites W1657589180 @default.
- W2031736349 cites W1675418333 @default.
- W2031736349 cites W1685669438 @default.
- W2031736349 cites W1809720545 @default.
- W2031736349 cites W1838503251 @default.
- W2031736349 cites W1964882117 @default.
- W2031736349 cites W1965017541 @default.
- W2031736349 cites W1967181211 @default.
- W2031736349 cites W1970970788 @default.
- W2031736349 cites W1973002996 @default.
- W2031736349 cites W1973784108 @default.
- W2031736349 cites W1974399527 @default.
- W2031736349 cites W1976183952 @default.
- W2031736349 cites W1985075549 @default.
- W2031736349 cites W1985802040 @default.
- W2031736349 cites W1990885869 @default.
- W2031736349 cites W1991022349 @default.
- W2031736349 cites W1994941102 @default.
- W2031736349 cites W1995176226 @default.
- W2031736349 cites W2005222662 @default.
- W2031736349 cites W2008452388 @default.
- W2031736349 cites W2008835519 @default.
- W2031736349 cites W2013813325 @default.
- W2031736349 cites W2014373146 @default.
- W2031736349 cites W2014448204 @default.
- W2031736349 cites W2014518900 @default.
- W2031736349 cites W2014804391 @default.
- W2031736349 cites W2016535707 @default.
- W2031736349 cites W2017870477 @default.
- W2031736349 cites W2028679942 @default.
- W2031736349 cites W2031856198 @default.
- W2031736349 cites W2033851189 @default.
- W2031736349 cites W2036281255 @default.
- W2031736349 cites W2043962744 @default.
- W2031736349 cites W2049336078 @default.
- W2031736349 cites W2054305425 @default.
- W2031736349 cites W2055668479 @default.
- W2031736349 cites W2060606179 @default.
- W2031736349 cites W2062546233 @default.
- W2031736349 cites W2067523525 @default.
- W2031736349 cites W2070131827 @default.
- W2031736349 cites W2074042446 @default.
- W2031736349 cites W2077519163 @default.
- W2031736349 cites W2077903529 @default.
- W2031736349 cites W2081745608 @default.
- W2031736349 cites W2082446910 @default.
- W2031736349 cites W2083398291 @default.
- W2031736349 cites W2086401803 @default.
- W2031736349 cites W2086833100 @default.
- W2031736349 cites W2092264158 @default.
- W2031736349 cites W2094964719 @default.
- W2031736349 cites W2098173702 @default.
- W2031736349 cites W2108244488 @default.
- W2031736349 cites W2130021866 @default.
- W2031736349 cites W2131214730 @default.
- W2031736349 cites W2142947336 @default.
- W2031736349 cites W2330875501 @default.
- W2031736349 cites W2950674591 @default.
- W2031736349 cites W3192211684 @default.
- W2031736349 cites W55028243 @default.
- W2031736349 doi "https://doi.org/10.1063/1.3693762" @default.
- W2031736349 hasPubMedId "https://pubmed.ncbi.nlm.nih.gov/22443764" @default.
- W2031736349 hasPublicationYear "2012" @default.
- W2031736349 type Work @default.
- W2031736349 sameAs 2031736349 @default.
- W2031736349 citedByCount "12" @default.
- W2031736349 countsByYear W20317363492012 @default.
- W2031736349 countsByYear W20317363492014 @default.
- W2031736349 countsByYear W20317363492015 @default.
- W2031736349 countsByYear W20317363492016 @default.
- W2031736349 countsByYear W20317363492017 @default.
- W2031736349 countsByYear W20317363492018 @default.
- W2031736349 countsByYear W20317363492022 @default.
- W2031736349 crossrefType "journal-article" @default.
- W2031736349 hasAuthorship W2031736349A5032963653 @default.
- W2031736349 hasAuthorship W2031736349A5062129951 @default.
- W2031736349 hasAuthorship W2031736349A5078424123 @default.
- W2031736349 hasBestOaLocation W20317363492 @default.
- W2031736349 hasConcept C102931765 @default.
- W2031736349 hasConcept C106978608 @default.
- W2031736349 hasConcept C121332964 @default.
- W2031736349 hasConcept C121704057 @default.
- W2031736349 hasConcept C147120987 @default.
- W2031736349 hasConcept C147789679 @default.