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Wyszukujesz frazę ""[ CHIM.THEO ] Chemical Sciences/Theoretical and/or physical chemistry"" wg kryterium: Temat


Wyświetlanie 1-16 z 16
Tytuł :
Enhancing Double-Beam Laser Tweezers Raman Spectroscopy (LTRS) for the Photochemical Study of Individual Airborne Microdroplets
Autorzy :
Gómez Castaño, Jovanny A.
Boussekey, Luc
Verwaerde, Jean P.
Moreau, Myriam
Tobón, Yeny A.
Pokaż więcej
Temat :
[CHIM.THEO]Chemical Sciences/Theoretical and/or physical chemistry
laser tweezers Raman spectroscopy (LTRS)
Organic chemistry
QD241-441
photochemical reactions in Earth’s atmosphere
photochemical reactions in Earth's atmosphere
optical levitation
optical traps
atmospheric aerosols
Article
Źródło :
Molecules, MDPI, 2019, 24 (18), pp.3325. ⟨10.3390/molecules24183325⟩
Molecules, Vol 24, Iss 18, p 3325 (2019)
Opis pliku :
application/pdf
Tytuł :
Mechanistic and Structural Insights on the IL-15 System through Molecular Dynamics Simulations
Autorzy :
Rui P. Sousa
Adèle D. Laurent
Agnès Quéméner
Erwan Mortier
Jean-Yves Le Questel
Pokaż więcej
Temat :
molecular dynamics simulations
[CHIM.THEO]Chemical Sciences/Theoretical and/or physical chemistry
[SDV.CAN]Life Sciences [q-bio]/Cancer
interleukin 15
Organic chemistry
QD241-441
[SDV.IMM]Life Sciences [q-bio]/Immunology
IL-15 interfaces
protein protein interactions
Article
Źródło :
Molecules, MDPI, 2019, 24 (18), pp.3261. ⟨10.3390/molecules24183261⟩
Molecules, Vol 24, Iss 18, p 3261 (2019)
Opis pliku :
application/pdf
Tytuł :
A Spectroscopic Study of Tautomeric Equilibrium of Salicylideneaniline in ZSM-5 Zeolites
Autorzy :
Hureau, Matthieu
Moissette, Alain
Smirnov, Konstantin S.
Pokaż więcej
Temat :
ZSM-5
DFT calculations
zeolite
[CHIM.THEO]Chemical Sciences/Theoretical and/or physical chemistry
salicylideneaniline
tautomer
spectroscopy
Organic chemistry
QD241-441
equilibrium
Article
Źródło :
Molecules, Vol 24, Iss 4, p 795 (2019)
Molecules, MDPI, 2019, 24 (4), pp.795. ⟨10.3390/molecules24040795⟩
Opis pliku :
application/pdf
Tytuł :
Full-Dimensional Ab Initio Potential Energy Surface and Vibrational Energy Levels of Li2H
Autorzy :
Furudate, Michiko Ahn
Hagebaum-Reignier, Denis
Jeung, Gwang-Hi
Pokaż więcej
Temat :
Li2H
multi-reference configuration interaction
[CHIM.THEO]Chemical Sciences/Theoretical and/or physical chemistry
excited states
Organic chemistry
QD241-441
dilithium hydride
vibrational configuration interaction
potential energy surface
Article
Źródło :
Molecules, Vol 24, Iss 1, p 26 (2018)
Molecules, MDPI, 2019, 24 (1), pp.26. ⟨10.3390/molecules24010026⟩
Opis pliku :
application/pdf
Tytuł :
A Theoretical Study of the N to O Linkage Photoisomerization Efficiency in a Series of Ruthenium Mononitrosyl Complexes
Autorzy :
Boggio-Pasqua, Martial
Sanz García, Juan
Talotta, Francesco
Alary, Fabienne
Dixon, Isabelle
Heully, Jean-Louis
Pokaż więcej
Temat :
[CHIM.THEO]Chemical Sciences/Theoretical and/or physical chemistry
photochromism
Organic chemistry
QD241-441
density functional theory
photoisomerization
computational photochemistry
Article
Źródło :
Molecules, Vol 22, Iss 10, p 1667 (2017)
Molecules : A Journal of Synthetic Chemistry and Natural Product Chemistry
Molecules, MDPI, 2017, 22 (10), pp.1667. ⟨10.3390/molecules22101667⟩
Tytuł :
Xanthines Studied via Femtosecond Fluorescence Spectroscopy
Autorzy :
Changenet-Barret, P.
Kovács, L.
Markovitsi, D.
Gustavsson, T.
Pokaż więcej
Temat :
[CHIM.THEO]Chemical Sciences/Theoretical and/or physical chemistry
femtosecond spectroscopy
electronic excited states
fluorescence
Organic chemistry
QD241-441
xanthines
Article
Źródło :
Molecules, Vol 21, Iss 12, p 1668 (2016)
Molecules, MDPI, 2016, 21 (12), pp.1668. ⟨10.3390/molecules21121668⟩
Tytuł :
X-ray Single Crystal Structure, DFT Calculations and Biological Activity of 2-(3-Methyl-5-(pyridin-2’-yl)-1H-pyrazol-1-yl) Ethanol
Autorzy :
Radi, Smaail
Attayibat, Ahmed
El-Massaoudi, Mohamed
Salhi, Amin
Eddike, Driss
Tillard, Monique
Mabkhot, Yahia
Pokaż więcej
Temat :
DFT calculations
[CHIM.THEO]Chemical Sciences/Theoretical and/or physical chemistry
Parr functions
biological activity
QD241-441
[CHIM.ORGA]Chemical Sciences/Organic chemistry
single-crystal
reactivity indices
Article
Fukui functions
Organic chemistry
[CHIM.CRIS]Chemical Sciences/Cristallography
pyridylpyrazole
Źródło :
Molecules, Vol 21, Iss 8, p 1020 (2016)
Molecules, MDPI, 2016, ⟨10.3390/molecules21081020⟩
Tytuł :
beta-Keto-enol Tethered Pyridine and Thiophene: Synthesis, Crystal Structure Determination and its Organic Immobilization on Silica for Efficient Solid-Liquid Extraction of Heavy Metals.
Autorzy :
Tillard, Monique
Radi, Smaail
Tighadouini, Said
Bacquet, Maryse
Degoutin, Stephanie
Dacquin, Jean-Philippe
Eddike, Driss
Mabkhot, Yahia
Pokaż więcej
Temat :
hybrid material
[CHIM.THEO]Chemical Sciences/Theoretical and/or physical chemistry
adsorption
heavy metals
Organic chemistry
QD241-441
[CHIM.ORGA]Chemical Sciences/Organic chemistry
[CHIM]Chemical Sciences
crystal structure
keto-enol
[CHIM.CRIS]Chemical Sciences/Cristallography
Article
Źródło :
Molecules, Vol 21, Iss 7, p 888 (2016)
Molecules, MDPI, 2016, 21, pp.888-900. ⟨10.3390/molecules21070888⟩
Tytuł :
Probing the Dynamics of Solvation and Structure of the OH- Ion in Aqueous Solution from Picosecond Transient Absorption Measurements
Autorzy :
Olivier Poizat
Guy Buntinx
Pokaż więcej
Temat :
bipyridine
[CHIM.THEO]Chemical Sciences/Theoretical and/or physical chemistry
[ CHIM.THEO ] Chemical Sciences/Theoretical and/or physical chemistry
Organic chemistry
QD241-441
transient absorption spectroscopy
hydroxide ion solvation
solvation dynamics
Article
TheoryofComputation_ANALYSISOFALGORITHMSANDPROBLEMCOMPLEXITY
Źródło :
Molecules, MDPI, 2010, 15, pp.3366 - 3377. 〈10.3390/molecules15053366〉
Molecules, Vol 15, Iss 5, Pp 3366-3377 (2010)
Molecules, MDPI, 2010, 15, pp.3366 - 3377. ⟨10.3390/molecules15053366⟩
Opis pliku :
application/pdf
Tytuł :
In Situ Electrochemical SFG/DFG Study of CN− and Nitrile Adsorption at Au from 1-Butyl-1-methyl-pyrrolidinium Bis(trifluoromethylsulfonyl) Amide Ionic Liquid ([BMP][TFSA]) Containing 4-{2-[1-(2-Cyanoethyl)-1,2,3,4-tetrahydroquinolin-6-yl]diazenyl} Benzonitrile (CTDB) and K[Au(CN)2]
Autorzy :
Benedetto Bozzini
Bertrand Busson
Audrey Gayral
Christophe Humbert
Claudio Mele
Catherine Six
Abderrahmane Tadjeddine
Pokaż więcej
Temat :
Physics - Chemical Physics
[CHIM.THEO]Chemical Sciences/Theoretical and/or physical chemistry
DFG
non-linear spectroscopy
QD241-441
1-butyl-1-methyl-pyrrolidinium bis(trifluoromethylsulfonyl) amide
spectroelectrochemistry
[PHYS.PHYS.PHYS-CHEM-PH]Physics [physics]/Physics [physics]/Chemical Physics [physics.chem-ph]
Article
Au
SFG
Organic chemistry
Physics - Optics
4-tetrahydroquinolin-6-yl]diazenyl} benzonitrile
electrodeposition
[PHYS.PHYS.PHYS-OPTICS]Physics [physics]/Physics [physics]/Optics [physics.optics]
4-{2-[1-(2-cyanoethyl)-1,2,3,4-tetrahydroquinolin-6-yl]diazenyl} benzonitrile
4-{2-[1-(2- cyanoethyl)-1
Źródło :
Molecules, Vol 17, Iss 7, Pp 7722-7736 (2012)
Molecules, MDPI, 2012, 17 (7), pp.7722-7736. ⟨10.3390/molecules17077722⟩
Opis pliku :
application/pdf
    Wyświetlanie 1-16 z 16

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