Coherent phonon control.

http://dx.doi.org

BioMAX the first macromolecular crystallography beamline at MAX IV Laboratory

BioMAX is the first macromolecular crystallography beamline at the MAX IV Laboratory 3 GeV storage ring, which is the first operational multi bend achromat storage ring. Due to the low emittance storage ring, BioMAX has a parallel, high intensity X ray beam, even when focused down to 20 mm 5 mm using the bendable focusing mirrors. The beam is tunable in the energy range 5 25 keV using the in vacuum undulator and the horizontally deflecting doublecrystal monochromator. BioMAX is equipped with an MD3 diffractometer, an ISARA high capacity sample changer and an EIGER 16M hybrid pixel detector. Data collection at BioMAX is controlled using the newly developed MXCuBE3 graphical user interface, and sample tracking is handled by ISPyB. The computing infrastructure includes data storage and processing both at MAX IV and the Lund University supercomputing center LUNARC. With state of the art instrumentation, a high degree of automation, a user friendly control system interface and remote operation, BioMAX provides an excellent facility for most macromolecular crystallography experiments. Serial crystallography using either a high viscosity extruder injector or the MD3 as a fixedtarget scanner is already implemented. The serial crystallography activities at MAX IV Laboratory will be further developed at the microfocus beamline MicroMAX, when it comes into operation in 2022. MicroMAX will have a 1 mm x 1 mm beam focus and a flux up to 10 15 photons s 1 with main applications in serial crystallography, room temperature structure determinations and time resolved experiment

Extension of the time-dependent dynamical diffraction theory to 'optical phonon'-type distortions: application to diffraction from coherent acoustic and optical phonons.

An extension of the time-dependent Takagi-Taupin theory to 'optical phonon'-type distortions is presented. By splitting the susceptibility into the contributions from each atom in a unit cell, modifications to the structure factor as well as lattice parameter are taken into account. The result is a compact, surprisingly simple, equation with a strong formal similarity to the classical Takagi-Taupin equation, with the latter included as a special case. Time dependence is explicitly retained and thus the analysis is applicable to situations where the crystal is modified on time scales comparable with that for the X-rays to traverse an extinction depth. A comparison is made between the influence of coherent acoustic and optical phonons on the diffraction of X-rays. Numerical and perturbative analytical solutions of the generalized Takagi-Taupin equation are presented in the presence of such phonons

Extension of the code suite FLY to a multi-cell postprocessor for hydrodynamic plasma simulation codes

The extension of the atomic kinetics code suite FLY to a multi-cell postprocessor for hydrodynamic plasma simulation codes, called SWARM is presented. First, the collisional radiative model on which FLY is based is reviewed as far as it corresponds to the model in SWARM, then more attention is paid to the differences. Multiple cell simulations require a more complicated algorithm to solve the radiative transfer problem, taking into account geometry and point of observation. The feedback of the radiation on the atomic state populations is taken into account in a more sophisticated escape factor model. Finally, the limitations of the model are discussed. © 2001 Elsevier Science Ltd. All rights reserved

Simulations of the phonon Bragg switch in GaAs

It has recently been proposed that X-rays can be switched on sub-picosecond time-scales by using laser-generated coherent optical phonons: The so called phonon Bragg switch. We present here detailed simulations of the efficiency of such a switch by solving the time-dependent generalized Takagi-Taupin equations utilizing a perturbative approach. We explore the switching efficiency in diffraction from the (004) planes of GaAs as a function of both excited phonon wave vector and amplitude. © 2005 Elsevier Ltd. All rights reserved