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1.
Phys Rev Lett ; 125(4): 047702, 2020 Jul 24.
Artículo en Inglés | MEDLINE | ID: mdl-32794809

RESUMEN

High order perturbation theory has seen an unexpected recent revival for controlled calculations of quantum many-body systems, even at strong coupling. We adapt integration methods using low-discrepancy sequences to this problem. They greatly outperform state-of-the-art diagrammatic Monte Carlo simulations. In practical applications, we show speed-ups of several orders of magnitude with scaling as fast as 1/N in sample number N; parametrically faster than 1/sqrt[N] in Monte Carlo simulations. We illustrate our technique with a solution of the Kondo ridge in quantum dots, where it allows large parameter sweeps.

3.
Sci Rep ; 7: 44628, 2017 03 16.
Artículo en Inglés | MEDLINE | ID: mdl-28300169

RESUMEN

Serial femtosecond crystallography requires reliable and efficient delivery of fresh crystals across the beam of an X-ray free-electron laser over the course of an experiment. We introduce a double-flow focusing nozzle to meet this challenge, with significantly reduced sample consumption, while improving jet stability over previous generations of nozzles. We demonstrate its use to determine the first room-temperature structure of RNA polymerase II at high resolution, revealing new structural details. Moreover, the double-flow focusing nozzles were successfully tested with three other protein samples and the first room temperature structure of an extradiol ring-cleaving dioxygenase was solved by utilizing the improved operation and characteristics of these devices [corrected].


Asunto(s)
Cristalografía/instrumentación , Reología/instrumentación , Simulación por Computador , ARN Polimerasa II/química , Saccharomyces cerevisiae/enzimología , Temperatura , Factores de Tiempo , Difracción de Rayos X
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