Numerical methods and programming
RUS  ENG    JOURNALS   PEOPLE   ORGANISATIONS   CONFERENCES   SEMINARS   VIDEO LIBRARY   PACKAGE AMSBIB  
General information
Latest issue
Archive

Search papers
Search references

RSS
Latest issue
Current issues
Archive issues
What is RSS



Num. Meth. Prog.:
Year:
Volume:
Issue:
Page:
Find







Numerical methods and programming, 2003, Volume 4, Issue 1, Pages 200–206 (Mi vmp716)  

Regularizing algorithms for constructing intermolecular potentials on the basis of experimental data

N. V. Anikeevaa, I. V. Kochikovb, G. M. Kuramshinac, A. G. Yagolaa

a Lomonosov Moscow State University, Faculty of Physics
b Lomonosov Moscow State University, Research Computing Center
c Lomonosov Moscow State University, Faculty of Chemistry
Abstract: An algorithm for constructing intermolecular potentials on the basis of experimental data on temperature dependence of the second virial coefficient is proposed. The problem of constructing the intermolecular potential is solved on the class of convex-concave functions. It is shown that our approach allows one to restore potentials of intermolecular interaction accurately enough.
Keywords: intermolecular potential, second virial coefficient, inverse problems, regularization theory.
UDC: 532.6
Language: Russian
Citation: N. V. Anikeeva, I. V. Kochikov, G. M. Kuramshina, A. G. Yagola, “Regularizing algorithms for constructing intermolecular potentials on the basis of experimental data”, Num. Meth. Prog., 4:1 (2003), 200–206
Citation in format AMSBIB
\Bibitem{AniKocKur03}
\by N.~V.~Anikeeva, I.~V.~Kochikov, G.~M.~Kuramshina, A.~G.~Yagola
\paper Regularizing algorithms for constructing intermolecular potentials on the basis of experimental data
\jour Num. Meth. Prog.
\yr 2003
\vol 4
\issue 1
\pages 200--206
\mathnet{http://mi.mathnet.ru/vmp716}
Linking options:
  • https://www.mathnet.ru/eng/vmp716
  • https://www.mathnet.ru/eng/vmp/v4/i1/p200
  • Citing articles in Google Scholar: Russian citations, English citations
    Related articles in Google Scholar: Russian articles, English articles
    Numerical methods and programming
    Statistics & downloads:
    Abstract page:223
    Full-text PDF :77
    References:3
     
      Contact us:
     Terms of Use  Registration to the website  Logotypes © Steklov Mathematical Institute RAS, 2025