Quantum mechanics
    
group of ÚTF MFF UK

Program to solve the nuclear dynamics of electron-molecule collisions
within local complex potential approximation for diatomic molecules

Description

The program LCP_Approx_For_Diatomic_Molecules solves the nuclear dynamics of the electron collisions with diatomic molecules within local complex potential approximation and calculates the vibrational excitation and dissociative attachment cross sections. It employs a numerical grid method introduced by T.N. Rescigno and C.W. McCurdy [1, 2] The program can be used for applications in molecular physics.

Authors

Acknowledgement

The work on this program was support by

Program and codes

The program was written in Fortran 90/95 and compiled by Intel Fortran Compiler. To solve a sparse linear system it uses the Direct Sparse Solver library from Intel Math Kernel Library (MKL).

References

[1]
T.N. Rescigno and C.W. McCurdy, Phys. Rev. A 62, 032706 (2000)
[2]
C.W. McCurdy, M. Baertschy, and T.N. Rescigno, J. Phys. B 37, R137-R187 (2004)
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