Monte Carlo study for optimal conditions in single-shot imaging with femtosecond x-ray laser pulses

Intense x-ray pulses from x-ray free electron lasers (XFELs) enable the unveiling of atomic structure in material and biological specimens via ultrafast single-shot exposures. As the radiation is intense enough to destroy the sample, a new sample must be provided for each x-ray pulse. These single-particle delivery schemes require careful optimization, though systematic study to find such optimal conditions is still lacking. We have investigated two major single-particle delivery methods: particle injection as flying objects and membrane-mount as fixed targets. The optimal experimental parameters were searched for via Monte Carlo simulations to discover that the maximum single-particle hit rate achievable is close to 40%.

[1]  W. H. Benner,et al.  Single particle X-ray diffractive imaging. , 2007, Nano letters.

[2]  Garth J. Williams,et al.  Single mimivirus particles intercepted and imaged with an X-ray laser , 2011, Nature.

[3]  Georg Weidenspointner,et al.  Femtosecond X-ray protein nanocrystallography , 2011, Nature.

[4]  U Weierstall,et al.  Injector for scattering measurements on fully solvated biospecies. , 2012, The Review of scientific instruments.

[5]  J. Miao,et al.  High numerical aperture tabletop soft x-ray diffraction microscopy with 70-nm resolution , 2008, Proceedings of the National Academy of Sciences.

[6]  J. Miao,et al.  Coherent X-Ray Diffraction Imaging , 2012, IEEE Journal of Selected Topics in Quantum Electronics.

[7]  T. Ishikawa,et al.  Imaging fully hydrated whole cells by coherent x-ray diffraction microscopy. , 2013, Physical review letters.

[8]  T. Ishikawa,et al.  A compact X-ray free-electron laser emitting in the sub-ångström region , 2012, Nature Photonics.

[9]  T. Ishikawa,et al.  Focusing of X-ray free-electron laser pulses with reflective optics , 2012, Nature Photonics.

[10]  Ryszard S. Romaniuk,et al.  Operation of a free-electron laser from the extreme ultraviolet to the water window , 2007 .

[11]  J. Miao,et al.  An approach to three-dimensional structures of biomolecules by using single-molecule diffraction images , 2001, Proceedings of the National Academy of Sciences of the United States of America.

[12]  K. Nugent Coherent methods in the X-ray sciences , 2009, 0908.3064.

[13]  Henry C. Kapteyn,et al.  High-harmonic generation: Ultrafast lasers yield X-rays , 2010 .

[14]  J. Hajdu,et al.  Potential for biomolecular imaging with femtosecond X-ray pulses , 2000, Nature.

[15]  H. N. Chapman,et al.  Imaging Atomic Structure and Dynamics with Ultrafast X-ray Scattering , 2007, Science.

[16]  Tetsuya Ishikawa,et al.  Pulse energy measurement at the hard x-ray laser in Japan , 2012 .