{
  "annotation_id": "4d57fbe5-0cfc-4f15-8175-817117781f63",
  "date_created": "2026-03-02T18:00:32.596000Z",
  "date_modified": "2026-03-02T18:00:32.596000Z",
  "file_hash": "f7ac9a340615b089638f9b6b0ca2b933d60b08f83b12f40829c3419d3f201056",
  "private": false,
  "record": {
    "abstract": "Optical properties of symmetry-forbidden pi-pi transitions in benzene are\ncalculated with the time-dependent density functional theory (TDDFT), using an\nadiabatic LDA functional. Quantities calculated are the envelopes of the\nFranck-Condon factors of the vibrationally promoted transitions and the\nassociated oscillator strengths. The strengths, which span three orders of\nmagnitude, are reproduced to better than a factor of two by the theory.\nComparable agreement is found for the Franck-Condon widths. We conclude that\nrather detailed information can be obtained with the TDDFT and it may be\nworthwhile to explore other density functionals.",
    "arxiv_id": "physics/0011001",
    "authors": [
      "A. Schnell",
      "G. F. Bertsch",
      "K. Yabana"
    ],
    "categories": [
      "physics.chem-ph"
    ],
    "title": "Application of time-dependent density functional theory to   electron-vibration coupling in benzene",
    "url": "https://arxiv.org/abs/physics/0011001"
  },
  "schema_id": "dorsal/arxiv",
  "source": {
    "execution_id": "64c6f4ba-ace4-4944-8dd7-38075f419545",
    "id": "arXiv Dataset IDs",
    "type": "Model",
    "variant": "snapshot-2026-03-01",
    "version": "0.1.0"
  },
  "user_id": 1000002
}