PulseExploreJournal ClubDebatesTrendingResearchersJournals
Instagram
HomeExploreJournal ClubTrending
Synapse
⌘+K
Synapse
February 8, 2001The Journal of Chemical Physics96 citationsOpen Access

Photoabsorption spectra in the continuum of molecules and atomic clusters

TNTakashi NakatsukasaKYKazuhiro Yabana

Key Points

Key points are not available for this paper at this time.

Abstract

We present linear response theories in the continuum capable of describing photoionization spectra and dynamic polarizabilities of finite systems with no spatial symmetry. Our formulations are based on the time-dependent local density approximation with uniform grid representation in the three-dimensional Cartesian coordinate. Effects of the continuum are taken into account either with a Green’s function method or with a complex absorbing potential in a real-time method. The two methods are applied to a negatively charged cluster in the spherical jellium model and to some small molecules (silane, acetylene and ethylene).

Ask AI
Helpful
Bookmark
Share
View Full Paper

Cite This Study

Nakatsukasa et al. (2001) studied this question.

synapsesocial.com/papers/6a5b76fbfe4964b367567c86https://doi.org/10.1063/1.1338527
Ask AI
Helpful
Bookmark
Share
View Full Paper

Also Consider

Synapse has enriched 5 closely related papers on similar clinical questions. Consider them for comparative context:

  1. 1Three-dimensional time-dependent Hartree-Fock calculations: Application to O16 + O16 collisions1978 · 253 citations
  2. 2Exchange and correlation in atoms, molecules, and solids by the spin-density-functional formalism1976 · 3,670 citations
  3. 3The photoelectron spectra of methane, silane, germane and stannane1972 · 216 citations
  4. 4The time-dependent Schrödinger equation: Application of absorbing boundary conditions1989 · 578 citations
  5. 5Ionizing and nonionizing decays of superexcited acetylene molecules in the extreme-ultraviolet region1991 · 52 citations