Evidence map›Paper›PMID 30987301›Full record

ArticleMolecules (Basel, Switzerland)2019

Excited State Frequencies of Chlorophyll f and Chlorophyll a and Evaluation of Displacement through Franck-Condon Progression Calculations.

Noura Zamzam, Jasper J van Thor

Abstract read
In one paragraph

Article in Molecules (Basel, Switzerland), 2019. The graph could read no effect estimate from its abstract, so it casts no vote on the map. Cited by 5 papers.

0numbers the graph read from it
0cells of the map it votes in
5citing papers in PubMed
–field-weighted citation impact
1 · What the graph read from it

What it found

Each row is one number read from the abstract, on the scale the paper reported it, with its interval. Left of the dashed line favours the treatment, right favours the comparator. Under each row is the sentence it came from. New to these charts? A ten-minute tutorial.

The abstract states no effect estimate the extractor could read, or names no intervention and outcome on the map, so this paper lights no cell and moves no belief. It is still indexed, cited and linked below.

2 · The registry

The trial behind it

Trials whose registry record cites this paper, or whose number appears in the abstract. A trial that started after this paper was published is citing it as background, not reporting it.

Neither the registry nor the abstract names a trial number. If this is a trial report, that itself is worth knowing.

3 · Its place in the literature

Who cites it

5 citing papers in PubMed.

  1. Article
  2. Is the AInternational journal of molecular sciences · 2024
    Article
  3. Quasiparticle Self-ConsistentJournal of chemical theory and computation · 2022
    Article
  4. Accurate Computation of the Absorption Spectrum of ChlorophyllThe journal of physical chemistry. B · 2020
    Article
  5. Article
4 · The record

Corrections and comments

PubMed lists nothing against this paper. Absence here is not a guarantee, only a check that was made.

5 · Who and what money

Authors and funding

2 authors.

Noura ZamzamDepartment of Life Sciences, Molecular Biophysics, Imperial College London, London SW7 2AZ, UK. n.zamzam16@imperial.ac.uk.ORCID 0000-0002-9021-2167
Jasper J van ThorDepartment of Life Sciences, Molecular Biophysics, Imperial College London, London SW7 2AZ, UK. j.vanthor@imperial.ac.uk.ORCID 0000-0001-6356-3116

Funding

The Leverhulme Trust RPG-2014-126
6 · The paper itself

Abstract

We present ground and excited state frequency calculations of the recently discovered extremely red-shifted chlorophyll f. We discuss the experimentally available vibrational mode assignments of chlorophyll f and chlorophyll a which are characterised by particularly large downshifts of 13¹-keto mode in the excited state. The accuracy of excited state frequencies and their displacements are evaluated by the construction of Franck-Condon (FC) and Herzberg-Teller (HT) progressions at the CAM-B3LYP/6-31G(d) level. Results show that while CAM-B3LYP results are improved relative to B3LYP calculations, the displacements and downshifts of high-frequency modes are underestimated still, and that the progressions calculated for low temperature are dominated by low-frequency modes rather than fingerprint modes that are Resonant Raman active.

Indexed as

Models, ChemicalAlgorithmsChlorophyllChlorophyll AModels, MolecularSpectrum AnalysisChlorophyllChlorophyll Achlorophyll fB3LYPCAM-B3LYPchlorophyll achlorophyll fdensity functional theoryexcited stateFranck–Condonvibrational frequencies

Identifiers

PMID30987301
PMCPMC6479460

What OpenQuestion holds

Textmetadata
LicenceCC BY
Read underepoch 390

Registered trials

None linked

Read under generation 80e0d062 · epoch 390. Bibliography from PubMed, PubMed Central and OpenAlex; grants from NIH RePORTER; trial links from ClinicalTrials.gov; estimates, votes and beliefs from the OpenQuestion graph.