Numerical method to solve chemical differential-algebraic equations

Celik E., Karaduman E., BAYRAM M.

INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, cilt.89, sa.5, ss.447-451, 2002 (SCI-Expanded) identifier identifier

  • Yayın Türü: Makale / Tam Makale
  • Cilt numarası: 89 Sayı: 5
  • Basım Tarihi: 2002
  • Doi Numarası: 10.1002/qua.10305
  • Dergi Adı: INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY
  • Derginin Tarandığı İndeksler: Science Citation Index Expanded (SCI-EXPANDED), Scopus
  • Sayfa Sayıları: ss.447-451
  • Anahtar Kelimeler: arbitrary order, differential-algebraic equation, Pade series, Power series, SCHRODINGER-EQUATION, CONSISTENT INITIALIZATION
  • Atatürk Üniversitesi Adresli: Evet

Özet

In this article, the solution of a chemical differential-algebraic equation model of general type F(y, y', x) = 0 has been done using MAPLE computer algebra systems. The MAPLE program is given in the Appendix. First we calculate the Power series of the given equations system, then we transform it into Pade series form, which gives an arbitrary order for solving chemical differential-algebraic equation numerically. (C) 2002 Wiley Periodicals, Inc.