-
Quasi-classical trajectory method is used to investigate the influence of rotational excitation on the vector properties of the dynamics for the reaction O+HBrOH+Br based on the abinitio potential energy surface. At the collision energy 0.3 eV, we discuss the polarization-dependent differential cross sections (PDDCSs), the distribution P(r) describing k - j correlation, and the distribution P(r) describing k - k- j correlation. The calculated results suggest that the product rotational polarization becomes weaker as the rotational quantum number increases and the products are mainly forward scattered.
[1] Brandt D, Polanyi J C 1978 Chem. Phys. 35 23
[2] Balucani N, Beneventi L, Casavecchia P, Volpi G G, Kruus E J, Sloan J J 1994 Can. J. Chem. 72 888
[3] Füsti-Molnar L, Szalay P G, Balint-Kurti G G 1999 J. Chem. Phys. 110 8448
[4] Lock M, Barnes R J, Sinha A 1996 J. Phys. Chem. 100 7972
[5] Peterson K A 2000 J. Chem. Phys. 113 4598
[6] Gogtas F 2006 Chem. Phys. 328 421
[7] Tang B Y, Tang Q K, Chen M D, Han K Li, Zhang Z H 2004 J. Chem. Phys. 120 8537
[8] Li W L, Wang M S, Yang C L, Guang M X, Wang D H, Liu W W 2007 Chem. Phys. Lett. 445 125
[9] Li W L, Wang M S, Dong Y M, Yang C L 2008 Chem. Phys. 348 97
[10] Chen M D, Han K L, Lou N Q 2002 Chem. Phys. Lett. 357 483
[11] Liu Y F, Zhu Z L, Sun J F, Cong S L, Han K L 2003 Chin. Phys. 12 750
[12] Zhang C H, Zhang W Q, Chen M D 2009 J. Theo. Com. Chem. 2 1
[13] Peterson K A, Skokov S, Bowman J M 1999 J. Chem. Phys. 111 7446
[14] Skokov S, Peterson K A, Bowman J M 1999 Chem. Phys. Lett. 312 494
[15] Zhang Z H, Chen M D, Cong S L 2008 Chem. Res. Universities 24 223
[16] Zhang Z H, Chen M D, Cong S L 2008 Chem. J. Chinese Universities 29 596 (in Chinese) [张志红, 陈茂笃, 丛书林 2008 高等学校化学学报 29 596]
[17] Aoiz F J, Brouard M, Enriquez P A 1996 J. Chem. Phys. 105 4964
[18] Shafer-Ray N E, Orr-Ewing A J, Zare R N 1995 J. Phys. Chem. 99 7591
[19] Chen M D, Han K L, Lou N Q 2002 Chem. Phys. Lett. 357 483
[20] Chen M D, Han K L, Lou N Q 2003 Chem. Phys. 118 4463
[21] Xu Y, Zhao J, Wang J, Liu F, Meng Q T 2010 Acta Phys. Sin. 59 3885 (in Chinese) [徐燕, 赵娟, 王军, 刘芳, 孟庆田 2010 59 3885]
[22] Xue W D, Zhu Z H, Ran M, Wang H Y, Zou L X, Sun Y 2002 Acta Phys. Sin. 51 2503 (in Chinese) [薛卫东, 朱正和, 冉鸣, 王红艳, 邹乐西, 孙颖 2002 51 2503]
[23] Shen G X, Wang R K, Linghu R F, Yang X D 2008 Acta Phys. Sin. 57 155 (in Chinese) [沈光先, 汪荣凯, 令狐荣锋, 杨向东 2008 57 155]
[24] Wang R K, Shen G X, Linghu R F, Yang X D 2008 Acta Phys. Sin. 57 4138 (in Chinese) [汪荣凯, 沈光先, 令狐荣锋, 杨向东 2008 57 4138]
[25] Xu Y, Zhao J, Yue D G, Liu H, Zheng X Y, Meng Q T 2009 Chin. Phys. B 18 5308
[26] Zhao J, Xu Y, Meng Q T 2010 Chin. Phys. B 19 063403
[27] Li H, Zheng B , Yin J Q, Meng Q T 2011 Chin. Phys. B 20 123401
-
[1] Brandt D, Polanyi J C 1978 Chem. Phys. 35 23
[2] Balucani N, Beneventi L, Casavecchia P, Volpi G G, Kruus E J, Sloan J J 1994 Can. J. Chem. 72 888
[3] Füsti-Molnar L, Szalay P G, Balint-Kurti G G 1999 J. Chem. Phys. 110 8448
[4] Lock M, Barnes R J, Sinha A 1996 J. Phys. Chem. 100 7972
[5] Peterson K A 2000 J. Chem. Phys. 113 4598
[6] Gogtas F 2006 Chem. Phys. 328 421
[7] Tang B Y, Tang Q K, Chen M D, Han K Li, Zhang Z H 2004 J. Chem. Phys. 120 8537
[8] Li W L, Wang M S, Yang C L, Guang M X, Wang D H, Liu W W 2007 Chem. Phys. Lett. 445 125
[9] Li W L, Wang M S, Dong Y M, Yang C L 2008 Chem. Phys. 348 97
[10] Chen M D, Han K L, Lou N Q 2002 Chem. Phys. Lett. 357 483
[11] Liu Y F, Zhu Z L, Sun J F, Cong S L, Han K L 2003 Chin. Phys. 12 750
[12] Zhang C H, Zhang W Q, Chen M D 2009 J. Theo. Com. Chem. 2 1
[13] Peterson K A, Skokov S, Bowman J M 1999 J. Chem. Phys. 111 7446
[14] Skokov S, Peterson K A, Bowman J M 1999 Chem. Phys. Lett. 312 494
[15] Zhang Z H, Chen M D, Cong S L 2008 Chem. Res. Universities 24 223
[16] Zhang Z H, Chen M D, Cong S L 2008 Chem. J. Chinese Universities 29 596 (in Chinese) [张志红, 陈茂笃, 丛书林 2008 高等学校化学学报 29 596]
[17] Aoiz F J, Brouard M, Enriquez P A 1996 J. Chem. Phys. 105 4964
[18] Shafer-Ray N E, Orr-Ewing A J, Zare R N 1995 J. Phys. Chem. 99 7591
[19] Chen M D, Han K L, Lou N Q 2002 Chem. Phys. Lett. 357 483
[20] Chen M D, Han K L, Lou N Q 2003 Chem. Phys. 118 4463
[21] Xu Y, Zhao J, Wang J, Liu F, Meng Q T 2010 Acta Phys. Sin. 59 3885 (in Chinese) [徐燕, 赵娟, 王军, 刘芳, 孟庆田 2010 59 3885]
[22] Xue W D, Zhu Z H, Ran M, Wang H Y, Zou L X, Sun Y 2002 Acta Phys. Sin. 51 2503 (in Chinese) [薛卫东, 朱正和, 冉鸣, 王红艳, 邹乐西, 孙颖 2002 51 2503]
[23] Shen G X, Wang R K, Linghu R F, Yang X D 2008 Acta Phys. Sin. 57 155 (in Chinese) [沈光先, 汪荣凯, 令狐荣锋, 杨向东 2008 57 155]
[24] Wang R K, Shen G X, Linghu R F, Yang X D 2008 Acta Phys. Sin. 57 4138 (in Chinese) [汪荣凯, 沈光先, 令狐荣锋, 杨向东 2008 57 4138]
[25] Xu Y, Zhao J, Yue D G, Liu H, Zheng X Y, Meng Q T 2009 Chin. Phys. B 18 5308
[26] Zhao J, Xu Y, Meng Q T 2010 Chin. Phys. B 19 063403
[27] Li H, Zheng B , Yin J Q, Meng Q T 2011 Chin. Phys. B 20 123401
Catalog
Metrics
- Abstract views: 7009
- PDF Downloads: 557
- Cited By: 0
下载:
