Zobrazeno 1 - 10
of 31
pro vyhledávání: '"Alain Fritsch"'
Publikováno v:
Imagination, Cognition and Personality. 42:352-371
Self-defining future projections (SDFPs) have never been explored across lifespan. The present study aimed to characterize those self-relevant narratives in three age groups matched for sex and education level: young (mean age = 23.0 years), middle-a
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::5bdb3128542325903e39ba66c5fc1d05
https://doi.org/10.1177/02762366221147849
https://doi.org/10.1177/02762366221147849
Publikováno v:
Current Aging Science. 16
Background: Self-defining future projections (SDFP) are mental representations of plausible and highly significant future events that provide core information of one’s understanding of self. Objective: We explored SDFPs in a large sample of older a
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::2d8d20b13dca70b568797cd34de5ca26
https://doi.org/10.2174/1874609816666230330092556
https://doi.org/10.2174/1874609816666230330092556
Autor:
Jean-Luc Bruneel, Coralie Martin, Alain Fritsch, François Guillaume, Frédéric Castet, Pierre-Louis Teissedre, Michael Jourdes
Publikováno v:
Food Chemistry
Food Chemistry, Elsevier, 2017, 221, pp.568-575. ⟨10.1016/j.foodchem.2016.11.137⟩
Food Chemistry, Elsevier, 2017, 221, pp.568-575. ⟨10.1016/j.foodchem.2016.11.137⟩
Model solutions of white wines containing phenolic acids have been investigated by means of UV–vis, laser induced fluorescence and Raman spectroscopic techniques. In order to interpret the spectra, density functional theory calculations of phenolic
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::28bbd43ea05ff213037a35cd00a6527f
https://pubmed.ncbi.nlm.nih.gov/27979242
https://pubmed.ncbi.nlm.nih.gov/27979242
Autor:
Laurent Ducasse, Julien Idé, Adrien Savoyant, Jérôme Cornil, Raphaël Méreau, Frédéric Castet, Alain Fritsch, David Beljonne, Philippe Aurel, Sébastien Mothy
Publikováno v:
International Journal of Quantum Chemistry. 113:580-584
Quantum-chemical calculations are performed at the semiempirical Valence-Bond/Hartree–Fock level on model 1D aggregates to assess the electronic structure at pentacene/C60 heterojunctions. We show that the asymmetry of the electrostatic potential a
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::7b2008a2a22694837819baf4b49474b5
https://doi.org/10.1002/qua.24006
https://doi.org/10.1002/qua.24006
Autor:
Frédéric Castet, Philippe d’Antuono, Laurent Ducasse, Yannick Landais, Alain Fritsch, Philippe James
Publikováno v:
Journal of Physical Chemistry A
Journal of Physical Chemistry A, American Chemical Society, 2006, 110, pp.3714-3722. ⟨10.1021/jp0549531⟩
Journal of Physical Chemistry A, American Chemical Society, 2006, 110, pp.3714-3722. ⟨10.1021/jp0549531⟩
Free radical-mediated 5-exo-trig cyclizations of hepta-1,6-dienes incorporating allylsilane, alkyl and alkoxy analogues are modeled using correlated ab initio calculations. The structural, electronic and thermochemical properties of reactants, produc
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::50ca89646d3657222e561de66ecf489b
https://doi.org/10.1021/jp0549531
https://doi.org/10.1021/jp0549531
Publikováno v:
International Journal of Quantum Chemistry. 106:734-746
A semi-empirical valence bond/Hartree–Fock (VB/HF) method is developed to calculate one- and two-electron interactions between molecular fragments in conducting supramolecular stacks. This fragment orbital-based formalism allows for consistent extr
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::ad55c9990638dc7963f605ddf9a099c2
https://doi.org/10.1002/qua.20838
https://doi.org/10.1002/qua.20838
Publikováno v:
Journal of Molecular Structure. 649:177-190
Bis-curcuminoids 3 and 4 , bearing a diphenylmethane bridge for both compounds and a crown ether chain adapted to complex Li + for compound 4 , were synthesized and characterized by mass and NMR spectroscopies. By their preorganized geometry, they re
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::796fdc670cc4d8cea746e1fb01734c13
https://doi.org/10.1016/s0022-2860(03)00050-4
https://doi.org/10.1016/s0022-2860(03)00050-4
Publikováno v:
Physical Chemistry Chemical Physics. 4:6072-6079
A new electronic effective hamiltonian based on a quantum cell formalism is used to calculate the charge distributions when a single hole is delocalised along B-DNA double strands. This scheme allows one to deal with very large sequences while includ
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::87de7e360c0989e40abf77b28fc56a29
https://doi.org/10.1039/b208655g
https://doi.org/10.1039/b208655g
Publikováno v:
The Journal of Physical Chemistry B. 105:12665-12673
The valence bond/Hartree−Fock (VB/HF) formalism [F. Castet et al., J. Phys. I (France), 1996, 6, 583; Chem. Phys. 1998, 232, 37] is applied to calculate the transfer integrals between interacting f...
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::a131aaebfa84ed3aa5e66744525baec7
https://doi.org/10.1021/jp012737w
https://doi.org/10.1021/jp012737w
Publikováno v:
Chemical Physics. 269:107-124
A new hybrid method associating an effective spin hamiltonian with an approximate spin function is applied to an infinite s=1/2 magnetic chain. The effective spin hamiltonian is derived from the single configuration spin-coupled valence bond wave fun
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::df7b576cef11541bfd23849e04c8bd2a
https://doi.org/10.1016/s0301-0104(01)00316-0
https://doi.org/10.1016/s0301-0104(01)00316-0