𝔖 Bobbio Scriptorium
✦   LIBER   ✦

BEYOND BORN-OPPENHEIMER: Molecular Dynamics Through a Conical Intersection

✍ Scribed by Worth, Graham A.; Cederbaum, Lorenz S.

Book ID
115502394
Publisher
Annual Reviews
Year
2004
Tongue
English
Weight
825 KB
Volume
55
Category
Article
ISSN
0066-426X

No coin nor oath required. For personal study only.

📜 SIMILAR VOLUMES

‘Classical wavepacket’ dynamics through
‘Classical wavepacket’ dynamics through a conical intersection. Application to the S1/S0 photochemistry of benzene
✍ Barry R. Smith; Michael J. Bearpark; Michael A. Robb; Fernando Bernardi; Massimo 📂 Article 📅 1995 🏛 Elsevier Science 🌐 English ⚖ 409 KB

Excited state dynamics calculations (using semiclassical surface-hopping trajectories first described by Tully and Preston) have been carried out in order to explain the low quantum yield for the photochemical production of benzvalene from benzene. Trajectories are propagated using a series of local

Exact numerical calculations of dissocia
Exact numerical calculations of dissociative-ionization of molecular ions in intense laser fields: Non-Born–Oppenheimer dynamics
✍ S. Chelkowski; C. Foisy; A. D. Bandrauk 📂 Article 📅 1997 🏛 John Wiley and Sons 🌐 English ⚖ 231 KB 👁 1 views

The time-dependent Schrodinger equation for the 1-D H q molecule ¨2 Ž . with both nuclear and electronic degrees of freedom included was solved numerically. A wave᎐function splitting technique was used, which allows one to circumvent the problem of lost information due to commonly used absorbing bou