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Download lectures
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Lecturer
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Topics
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Download |
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Lect
I
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Vudichai
Parasuk
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HF
methods and Introduction to electron correlation- single-reference
methods; Optimization of geometries and other stationary points in
the ground state
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pdf |
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Lect
II
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Hans
Lischka
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Introduction
to CI and MRCI methods, Born-Oppenheimer approximation and
nonadiabatic couplings; conical intersections
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pdf1,
pdf2, pdf3 |
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Lect
III
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Thomas
Mueller
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Calculation
of excited states, vertical excitations, construction of reference
spaces, valence and Rydberg states
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pdf |
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Lect
IV
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Mario
Barbatti
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Photochemistry:
adiabatic and nonadiabatic molecular dynamics with multireference ab
initio methods
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pdf1,
pdf2, pdf3 |
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Lect
V
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Thomas
Mueller
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Parallelization
techniques in Quantum Chemistry
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pdf |
Guide
for the pratical lessons (including the answers): pdf
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