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MD simulation
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Mgr. Radim Cajzl
External academic staff at Faculty of Mathematics and Physics
2 publications
Publications
publication
The vertical excitation energies and a lifetime of the two lowest singlet excited states of the conjugated polyenes from C2 to C22: Ab initio, DFT, and semiclassical MNDO-MD simulations
2023 |
Faculty of Mathematics and Physics
publication
Interactions of the "piano-stool" [ruthenium(II)((6)-arene)(quinolone)Cl](+) complexes with water; DFT computational study
2016 |
Faculty of Mathematics and Physics
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