Ultrafast population transfer to excited valence levels of a molecule driven by x-ray pulses

Haxton, D. J.; McCurdy, C. W.

doi:10.1103/PhysRevA.90.053426

Title: Ultrafast population transfer to excited valence levels of a molecule driven by x-ray pulses

Journal Article · Fri Nov 21 00:00:00 EST 2014 · Physical Review A - Atomic, Molecular, and Optical Physics

DOI:https://doi.org/10.1103/PhysRevA.90.053426· OSTI ID:1179673

Haxton, D. J.; McCurdy, C. W.

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Sponsoring Organization:: USDOE Office of Science (SC), Basic Energy Sciences (BES)

Grant/Contract Number:: FG02-11ER16249

OSTI ID:: 1179673

Journal Information:: Physical Review A - Atomic, Molecular, and Optical Physics, Journal Name: Physical Review A - Atomic, Molecular, and Optical Physics Vol. 90 Journal Issue: 5; ISSN 1050-2947

Publisher:: American Physical SocietyCopyright Statement

Country of Publication:: United States

Language:: English

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Cited by: 19 works

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References (51)

Rydberg series in the NO molecule near 600 Å Sasanuma, M.; Morioka, Y.; Ishiguro, E. The Journal of Chemical Physics, Vol. 60, Issue 1 https://doi.org/10.1063/1.1680793	journal	January 1974
Vibrational structure and partial rates of resonant Auger decay of theN1s→2πcore excitations in nitric oxide Kukk, E.; Snell, G.; Bozek, J. D. Physical Review A, Vol. 63, Issue 6 https://doi.org/10.1103/PhysRevA.63.062702	journal	May 2001
Grid-based methods for diatomic quantum scattering problems. III. Double photoionization of molecular hydrogen in prolate spheroidal coordinates Tao, Liang; McCurdy, C. W.; Rescigno, T. N. Physical Review A, Vol. 82, Issue 2 https://doi.org/10.1103/PhysRevA.82.023423	journal	August 2010
Time-dependent restricted-active-space self-consistent-field theory for laser-driven many-electron dynamics Miyagi, Haruhide; Madsen, Lars Bojer Physical Review A, Vol. 87, Issue 6 https://doi.org/10.1103/PhysRevA.87.062511	journal	June 2013
A theoretical simulation of the 1s →2π excitation and deexcitation spectra of the NO molecule Fink, Reinhold The Journal of Chemical Physics, Vol. 106, Issue 10 https://doi.org/10.1063/1.473137	journal	March 1997
Solving the three-body Coulomb breakup problem using exterior complex scaling McCurdy, C. W.; Baertschy, M.; Rescigno, T. N. Journal of Physics B: Atomic, Molecular and Optical Physics, Vol. 37, Issue 17 https://doi.org/10.1088/0953-4075/37/17/R01	journal	August 2004
Absolute oscillator strengths for photoabsorption and the molecular and dissociative photoionization of nitric oxide Iida, Y.; Carnovale, F.; Daviel, S. Chemical Physics, Vol. 105, Issue 1-2 https://doi.org/10.1016/0301-0104(86)80070-2	journal	June 1986
Coherent Ultrafast Core-Hole Correlation Spectroscopy: X-Ray Analogues of Multidimensional NMR Schweigert, Igor V.; Mukamel, Shaul Physical Review Letters, Vol. 99, Issue 16 https://doi.org/10.1103/PhysRevLett.99.163001	journal	October 2007
Two-dimensional stimulated resonance Raman spectroscopy of molecules with broadband x-ray pulses Biggs, Jason D.; Zhang, Yu; Healion, Daniel The Journal of Chemical Physics, Vol. 136, Issue 17, Article No. 174117 https://doi.org/10.1063/1.4706899	journal	May 2012
Pseudospectral method for solving the time‐dependent Schrödinger equation in spherical coordinates Corey, Gregory C.; Lemoine, Didier The Journal of Chemical Physics, Vol. 97, Issue 6 https://doi.org/10.1063/1.463916	journal	September 1992
High-resolution inner-shell photoionization of NO Remmers, G.; Domke, M.; Puschmann, A. Chemical Physics Letters, Vol. 214, Issue 2 https://doi.org/10.1016/0009-2614(93)90088-I	journal	October 1993
Labs vie for X-ray source Samuel Reich, Eugenie Nature, Vol. 500, Issue 7460 https://doi.org/10.1038/500013a	journal	July 2013
Coherent X-Ray Raman Spectroscopy: A Nonlinear Local Probe for Electronic Excitations Tanaka, Satoshi; Mukamel, Shaul Physical Review Letters, Vol. 89, Issue 4 https://doi.org/10.1103/PhysRevLett.89.043001	journal	July 2002
Generalized discrete variable approximation in quantum mechanics Light, J. C.; Hamilton, I. P.; Lill, J. V. The Journal of Chemical Physics, Vol. 82, Issue 3 https://doi.org/10.1063/1.448462	journal	February 1985
Multiconfiguration time-dependent Hartree-Fock treatment of electronic and nuclear dynamics in diatomic molecules Haxton, D. J.; Lawler, K. V.; McCurdy, C. W. Physical Review A, Vol. 83, Issue 6 https://doi.org/10.1103/PhysRevA.83.063416	journal	June 2011
The multiconfiguration time-dependent Hartree (MCTDH) method: a highly efficient algorithm for propagating wavepackets Beck, M. Physics Reports, Vol. 324, Issue 1 https://doi.org/10.1016/S0370-1573(99)00047-2	journal	January 2000
Time-dependent multiconfiguration theory for ultrafast electronic dynamics of molecules in an intense laser field: Electron correlation and energy redistribution among natural orbitals Kato, Tsuyoshi; Kono, Hirohiko Chemical Physics, Vol. 366, Issue 1-3 https://doi.org/10.1016/j.chemphys.2009.09.017	journal	December 2009
Photoionization and photodissociation of nitric oxide in the range 9–35 eV Erman, P.; Karawajczyk, A.; Rachlew‐Källne, E. The Journal of Chemical Physics, Vol. 102, Issue 8 https://doi.org/10.1063/1.468616	journal	February 1995
Resonant Auger effect at high x-ray intensity Rohringer, Nina; Santra, Robin Physical Review A, Vol. 77, Issue 5 https://doi.org/10.1103/PhysRevA.77.053404	journal	May 2008
Pump and probe ultrafast electron dynamics in LiH: a computational study Nest, M.; Remacle, F.; Levine, R. D. New Journal of Physics, Vol. 10, Issue 2 https://doi.org/10.1088/1367-2630/10/2/025019	journal	February 2008
Multiple core-hole coherence in x-ray four-wave-mixing spectroscopies Mukamel, Shaul Physical Review B, Vol. 72, Issue 23 https://doi.org/10.1103/PhysRevB.72.235110	journal	December 2005
Time-dependent approach to electronically excited states of molecules with the multiconfiguration time-dependent Hartree-Fock method Nest, M.; Padmanaban, R.; Saalfrank, P. The Journal of Chemical Physics, Vol. 126, Issue 21 https://doi.org/10.1063/1.2743007	journal	June 2007
Full-dimensional (15-dimensional) quantum-dynamical simulation of the protonated water dimer. I. Hamiltonian setup and analysis of the ground vibrational state Vendrell, Oriol; Gatti, Fabien; Lauvergnat, David The Journal of Chemical Physics, Vol. 127, Issue 18 https://doi.org/10.1063/1.2787588	journal	November 2007
The multi-configurational time-dependent Hartree approach Meyer, H. -D.; Manthe, U.; Cederbaum, L. S. Chemical Physics Letters, Vol. 165, Issue 1 https://doi.org/10.1016/0009-2614(90)87014-I	journal	January 1990
Iterative diagonalization in the state-averaged multi-configurational time-dependent Hartree approach: Excited state tunneling splittings in malonaldehyde Hammer, Thorsten; Manthe, Uwe The Journal of Chemical Physics, Vol. 136, Issue 5 https://doi.org/10.1063/1.3681166	journal	February 2012
Time-dependent complete-active-space self-consistent-field method for multielectron dynamics in intense laser fields Sato, Takeshi; Ishikawa, Kenichi L. Physical Review A, Vol. 88, Issue 2 https://doi.org/10.1103/PhysRevA.88.023402	journal	August 2013
First lasing and operation of an ångstrom-wavelength free-electron laser Emma, P.; Akre, R.; Arthur, J. Nature Photonics, Vol. 4, Issue 9 https://doi.org/10.1038/nphoton.2010.176	journal	August 2010
Single Shot Spatial and Temporal Coherence Properties of the SLAC Linac Coherent Light Source in the Hard X-Ray Regime Gutt, C.; Wochner, P.; Fischer, B. Physical Review Letters, Vol. 108, Issue 2 https://doi.org/10.1103/PhysRevLett.108.024801	journal	January 2012
Intramolecular proton transfer in malonaldehyde: Accurate multilayer multi-configurational time-dependent Hartree calculations Hammer, Thorsten; Manthe, Uwe The Journal of Chemical Physics, Vol. 134, Issue 22 https://doi.org/10.1063/1.3598110	journal	June 2011
The definition of molecular resonance curves by the method of exterior complex scaling Simon, Barry Physics Letters A, Vol. 71, Issue 2-3 https://doi.org/10.1016/0375-9601(79)90165-8	journal	April 1979
Unified view on multiconfigurational time propagation for systems consisting of identical particles Alon, Ofir E.; Streltsov, Alexej I.; Cederbaum, Lorenz S. The Journal of Chemical Physics, Vol. 127, Issue 15 https://doi.org/10.1063/1.2771159	journal	October 2007
Femtosecond electronic response of atoms to ultra-intense X-rays Young, L.; Kanter, E. P.; Krässig, B. Nature, Vol. 466, Issue 7302 https://doi.org/10.1038/nature09177	journal	July 2010
A theoretical study of core excitation spectra of NO molecule Wang, F.; Larkins, F. P. Journal of Physics B: Atomic, Molecular and Optical Physics, Vol. 31, Issue 8 https://doi.org/10.1088/0953-4075/31/8/015	journal	April 1998
Expokit: a software package for computing matrix exponentials Sidje, Roger B. ACM Transactions on Mathematical Software, Vol. 24, Issue 1 https://doi.org/10.1145/285861.285868	journal	March 1998
A multiconfigurational time-dependent Hartree-Fock method for excited electronic states. I. General formalism and application to open-shell states Miranda, R. P.; Fisher, A. J.; Stella, L. The Journal of Chemical Physics, Vol. 134, Issue 24 https://doi.org/10.1063/1.3600397	journal	June 2011
Dynamics and Infrared Spectroscopy of the Protonated Water Dimer Vendrell, Oriol; Gatti, Fabien; Meyer, Hans-Dieter Angewandte Chemie International Edition, Vol. 46, Issue 36 https://doi.org/10.1002/anie.200702201	journal	September 2007
Absolute optical oscillator strengths for the photoabsorption of nitric oxide (5–30 eV) at high resolution Chang, W. F.; Cooper, G.; Brion, C. E. Chemical Physics, Vol. 170, Issue 1 https://doi.org/10.1016/0301-0104(93)80097-S	journal	February 1993
Full dimensional (15-dimensional) quantum-dynamical simulation of the protonated water dimer. II. Infrared spectrum and vibrational dynamics Vendrell, Oriol; Gatti, Fabien; Meyer, Hans-Dieter The Journal of Chemical Physics, Vol. 127, Issue 18 https://doi.org/10.1063/1.2787596	journal	November 2007
K absorption structure of the nitrogen atom in the nitric oxide molecule Morioka, Y.; Nakamura, M.; Ishiguro, E. The Journal of Chemical Physics, Vol. 61, Issue 4 https://doi.org/10.1063/1.1682069	journal	August 1974
High‐resolution and symmetry‐resolved N and O K ‐edge absorption spectra of NO Kosugi, Nobuhiro; Adachi, Jun‐ichi; Shigemasa, Eiji The Journal of Chemical Physics, Vol. 97, Issue 12 https://doi.org/10.1063/1.463359	journal	December 1992
Calculation of Matrix Elements for One‐Dimensional Quantum‐Mechanical Problems Dickinson, A. S.; Certain, P. R. The Journal of Chemical Physics, Vol. 49, Issue 9 https://doi.org/10.1063/1.1670738	journal	November 1968
Atomic inner-shell X-ray laser at 1.46 nanometres pumped by an X-ray free-electron laser Rohringer, Nina; Ryan, Duncan; London, Richard A. Nature, Vol. 481, Issue 7382 https://doi.org/10.1038/nature10721	journal	January 2012
Electron energy-loss studies of nitric oxide Stubbs, Richard J.; York, Trevor A.; Comer, John Chemical Physics, Vol. 106, Issue 1 https://doi.org/10.1016/0301-0104(86)87047-1	journal	July 1986
Multidimensional Attosecond Resonant X-Ray Spectroscopy of Molecules: Lessons from the Optical Regime Mukamel, Shaul; Healion, Daniel; Zhang, Yu Annual Review of Physical Chemistry, Vol. 64, Issue 1 https://doi.org/10.1146/annurev-physchem-040412-110021	journal	April 2013
A multilayer MCTDH study on the full dimensional vibronic dynamics of naphthalene and anthracene cations Meng, Qingyong; Meyer, Hans-Dieter The Journal of Chemical Physics, Vol. 138, Issue 1 https://doi.org/10.1063/1.4772779	journal	January 2013
High resolution absorption spectrum of nitric oxide (NO) in the region of the first ionization limit Miescher, E. Canadian Journal of Physics, Vol. 54, Issue 20 https://doi.org/10.1139/p76-246	journal	October 1976
Two-photon ionization of helium studied with the multiconfigurational time-dependent Hartree–Fock method Hochstuhl, David; Bonitz, Michael The Journal of Chemical Physics, Vol. 134, Issue 8 https://doi.org/10.1063/1.3553176	journal	February 2011
Single photoionization of Be and HF using the multiconfiguration time-dependent Hartree-Fock method Haxton, D. J.; Lawler, K. V.; McCurdy, C. W. Physical Review A, Vol. 86, Issue 1 https://doi.org/10.1103/PhysRevA.86.013406	journal	July 2012
The ground state tunneling splitting of malonaldehyde: Accurate full dimensional quantum dynamics calculations Coutinho-Neto, Maurı́cio D.; Viel, Alexandra; Manthe, Uwe The Journal of Chemical Physics, Vol. 121, Issue 19 https://doi.org/10.1063/1.1814356	journal	November 2004
Correlated multielectron systems in strong laser fields: A multiconfiguration time-dependent Hartree-Fock approach Caillat, J.; Zanghellini, J.; Kitzler, M. Physical Review A, Vol. 71, Issue 1 https://doi.org/10.1103/PhysRevA.71.012712	journal	January 2005
Numerical grid methods for quantum-mechanical scattering problems Rescigno, T. N.; McCurdy, C. W. Physical Review A, Vol. 62, Issue 3 https://doi.org/10.1103/PhysRevA.62.032706	journal	August 2000

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