Search results for "Atom- och molekylfysik och optik"

showing 3 items of 3 documents

Tracking Ca2+ ATPase intermediates in real time by x-ray solution scattering

2020

Sarco/endoplasmic reticulum Ca2+ ATPase (SERCA) transporters regulate calcium signaling by active calcium ion reuptake to internal stores. Structural transitions associated with transport have been characterized by x-ray crystallography, but critical intermediates involved in the accessibility switch across the membrane are missing. We combined time-resolved x-ray solution scattering (TR-XSS) experiments and molecular dynamics (MD) simulations for real-time tracking of concerted SERCA reaction cycle dynamics in the native membrane. The equilibrium [Ca2] E1 state before laser activation differed in the domain arrangement compared with crystal structures, and following laser-induced release o…

CONFORMATIONAL-CHANGESSERCAATPaseAtom and Molecular Physics and OpticsPUMPSTRUCTURAL DYNAMICSchemistry.chemical_elementCalciumCA2+-ATPASE03 medical and health sciencesPHOSPHOENZYME030304 developmental biologyCalcium signaling0303 health sciencesMultidisciplinarybiologyEndoplasmic reticulum030302 biochemistry & molecular biologySARCOPLASMIC-RETICULUMSettore FIS/07 - Fisica Applicata(Beni Culturali Ambientali Biol.e Medicin)MembranechemistryATPase time-resolved X-ray solution scatteringCytoplasmMOLECULAR-DYNAMICSbiology.proteinBiophysicsPhosphorylationSKELETAL-MUSCLEAtom- och molekylfysik och optikMEMBRANECALCIUM-TRANSPORT
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Beating Darwin-Bragg losses in lab-based ultrafast x-ray experiments

2017

The use of low temperature thermal detectors for avoiding Darwin-Bragg losses in lab-based ultrafast experiments has begun. An outline of the background of this new development is offered, showing the relevant history and initiative taken by this work. (C) 2017 Author(s). Funding Agencies|Knut and Alice Wallenberg Foundation; ERC [226136]; Finnish Funding Agency for Technology and Innovation TEKES; Academy of Finland [260880]; NIST Innovations in Measurement Science program; DOE Office of Basic Energy Sciences

Atom and Molecular Physics and OpticsPhysics::OpticsNanotechnology02 engineering and technology01 natural sciencesThermal detectorOpticsDarwin-Bragg loss0103 physical scienceslcsh:QD901-999010306 general physicsInstrumentationSpectroscopyPhysicsRadiationbusiness.industryArticleskidetiede021001 nanoscience & nanotechnologyCondensed Matter Physicsultrafast x-raysUltrafast Structural Dynamics—A Tribute to Ahmed H. ZewailDarwin (spacecraft)Atom- och molekylfysik och optiklcsh:Crystallography0210 nano-technologybusinessUltrashort pulseStructural Dynamics
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When the Grafting of Double Decker Phthalocyanines on Si(100)-2 × 1 Partly Affects the Molecular Electronic Structure

2016

International audience; A combined X-ray photoelectron spectroscopy (XPS), scanning tunneling microscopy (STM), and density functional theory (DFT) study has been performed to characterize the adsorbate interaction of lutetium biphthalocyanine (LuPc2) molecules on the Si(100)-2 × 1 surface. Large molecule–substrate adsorption energies are computed and are found to compete with the molecule–molecule interactions of the double decker molecules. A particularly good matching between STM images and computed ones confirms the deformation of the molecule upon the absorption process. The comparison between DFT calculations and XP spectra reveals that the electronic distribution in the two plateaus …

lutetium bi-phthalocyanineSiliconXASAtom and Molecular Physics and OpticsSTMAnalytical chemistrychemistry.chemical_element02 engineering and technology010402 general chemistryDFT[ CHIM ] Chemical Sciences01 natural sciencesSi(100)law.inventionAdsorptionX-ray photoelectron spectroscopyscanning tunneling microscopelawbasis-setXPS[CHIM]Chemical SciencessurfaceMoleculePhysical and Theoretical ChemistryBasis setmetal-free phthalocyaninefield-effect transistorsPhthalocyaninebis-phthalocyanine021001 nanoscience & nanotechnology0104 chemical sciencesSurfaces Coatings and FilmsElectronic Optical and Magnetic Materialstotal-energy calculationsGeneral EnergyElectronic Structurechemistrysi(001)Chemical physicsthin-filmsaugmented-wave methodAtom- och molekylfysik och optikDensity functional theoryScanning tunneling microscopeAbsorption (chemistry)0210 nano-technologyThe Journal of Physical Chemistry C
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