100+ B3lyp PowerPoint (PPT) Presentations, B3lyp PPTs

B3lyp - PowerPoint PPT Presentation

Kirin

Kirin. 2012/11/30. reaction pathways at different methods. reaction pathways in singlet ground state at different methods. There are no tautomer_trans_in forms in the singlet ground state at differenet methods. r eaction pathways in triplet ground state at different methods.

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494 views • 33 slides

3-hydroxypicolinaldehyde(3HPAL) 3-hydroxypicolinamide(3HPAM)

3-hydroxypicolinaldehyde(3HPAL) 3-hydroxypicolinamide(3HPAM). 2013/03/11. 3-hydroxypicolinaldehyde(3HPAL ). ?. Singlet excited states at TD-B3LYP/6-311+G** (optimized structures).

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377 views • 28 slides

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B3lyp - PowerPoint PPT Presentation

Kirin

3-hydroxypicolinaldehyde(3HPAL) 3-hydroxypicolinamide(3HPAM)