Sorted by objects
Theories of 2D Raman, 2D IR, 2D THz-Raman, etc.Sorted by methodologies
Hierarchy equations approach to quantum dissipative dynamics: non-perturbative & non-Markovian quantum Fokker-Planck and master equations. | |
Molecular Dynamics simulations for multi-dimensional spectroscopies: Calculating and analyzing multidimensional spectroscopy | |
Stochastic theory: Stochastic theory and its applications | |
Path Integral methods: Analytical calculations using the influence functional, variational principles, and perturbative expansion. | |
Monte Carlo Simulations: Frustrated systems, single molecular detection, quantum spin glass | |
Quantum chemistry calculations: Resonating Hartree-Fock Method, Biorthogonal approach for explicitly correlated calculations |
Lecture Notes
Lecture note on Learn Schrödinger, Dirac & Feynman formalisms in 90 minutes + Lagrangean (Zip file, May 19 2019) | |
Lecture note on reduced hierarchy equations of motion: Theory (Zip file, May 19 2019) | |
Lecture note on reduced hierarchy equations of motion: Applications (Zip file, May 19 2019) | |
Lecture note on the theory of multidimensional vibrational spectroscopy (Zip file, May 19 2019) | |
Lecture note on the theory of multidimensional electronic spectroscopy (Zip file, May 19 2019) |
Program Codes
Markovian2005 (Gaussian-Markovian master equation for a spin system coupled to 3D anisotropic baths) | |
nonMarkovian2009 (with low temperature correction terms, Jan 12, 2011 version) | |
nonMarkovian2009+2D (with low temperature correction terms+ subroutines for linear and 2D correlation spectra, Oct. 3rd, 2012 version) | |
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TanimuranFP15 (real-time and imaginary-time quantum hierarchal Fokker-Planck equations, March 21 , 2015 version) | |
GPU-HEOM (HEOM code
for CUDA) | |
Charge Flow Charge transfer
dipole-induced-dipole (CFCT-DID) Polarizability function for water program
(Bug fixed) | |
Low-temperature corrected quantum Fokker-Planck and multi-state quantum Fokker-Planck Eqs. T. Ikeda and Y. Tanimura, J. Chem. Theory Comput. 15 (2019). |