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Two-dimensional infrared spectroscopy of vibrational polaritons of molecules in an optical cavity.

The Journal of chemical physics

Saurabh P, Mukamel S.
PMID: 27036435
J Chem Phys. 2016 Mar 28;144(12):124115. doi: 10.1063/1.4944492.

Strong coupling of molecular vibrations to an infrared cavity mode affects their nature by creating dressed polariton states. We show how the single and double vibrational polariton manifolds may be controlled by varying the cavity coupling strength and probed...

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Saurabh P, Mukamel S. Two-dimensional infrared spectroscopy of vibrational polaritons of molecules in an optical cavity. J Chem Phys. 2016;144(12):124115doi: 10.1063/1.4944492.
Saurabh, P., & Mukamel, S. (2016). Two-dimensional infrared spectroscopy of vibrational polaritons of molecules in an optical cavity. The Journal of chemical physics, 144(12), 124115. https://doi.org/10.1063/1.4944492
Saurabh, Prasoon, and Mukamel, Shaul. "Two-dimensional infrared spectroscopy of vibrational polaritons of molecules in an optical cavity." The Journal of chemical physics vol. 144,12 (2016): 124115. doi: https://doi.org/10.1063/1.4944492
Saurabh P, Mukamel S. Two-dimensional infrared spectroscopy of vibrational polaritons of molecules in an optical cavity. J Chem Phys. 2016 Mar 28;144(12):124115. doi: 10.1063/1.4944492. PMID: 27036435.
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Electroluminescence in Molecular Junctions: A Diagrammatic Approach.

Journal of chemical theory and computation

Goswami HP, Hua W, Zhang Y, Mukamel S, Harbola U.
PMID: 26575925
J Chem Theory Comput. 2015 Sep 08;11(9):4304-15. doi: 10.1021/acs.jctc.5b00500. Epub 2015 Aug 21.

We compute electroluminescent signal in a current carrying single molecule junction using a superoperator formalism. Liouville space loop diagrams are used to identify all density matrix pathways that emit photons via the electroluminescence process. A frequency resolved spectrum is...

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Goswami HP, Hua W, Zhang Y, et al. Electroluminescence in Molecular Junctions: A Diagrammatic Approach. J Chem Theory Comput. 2015;11(9):4304-15doi: 10.1021/acs.jctc.5b00500.
Goswami, H. P., Hua, W., Zhang, Y., Mukamel, S., & Harbola, U. (2015). Electroluminescence in Molecular Junctions: A Diagrammatic Approach. Journal of chemical theory and computation, 11(9), 4304-15. https://doi.org/10.1021/acs.jctc.5b00500
Goswami, Himangshu Prabal, et al. "Electroluminescence in Molecular Junctions: A Diagrammatic Approach." Journal of chemical theory and computation vol. 11,9 (2015): 4304-15. doi: https://doi.org/10.1021/acs.jctc.5b00500
Goswami HP, Hua W, Zhang Y, Mukamel S, Harbola U. Electroluminescence in Molecular Junctions: A Diagrammatic Approach. J Chem Theory Comput. 2015 Sep 08;11(9):4304-15. doi: 10.1021/acs.jctc.5b00500. Epub 2015 Aug 21. PMID: 26575925.
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Multiple Core and Vibronic Coupling Effects in Attosecond Stimulated X-Ray Raman Spectroscopy (SXRS).

Journal of chemical theory and computation

Hua W, Biggs JD, Zhang Y, Healion D, Ren H, Mukamel S.
PMID: 24376391
J Chem Theory Comput. 2013 Dec 10;9(12). doi: 10.1021/ct400767g.

Attosecond Stimulated X-ray Raman Spectroscopy (SXRS) is a promising technique for investigating molecular electronic structure and photochemical processes with high spatial and temporal resolution. We present a theoretical study of SXRS from multiple core excitation sites of the same...

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Hua W, Biggs JD, Zhang Y, et al. Multiple Core and Vibronic Coupling Effects in Attosecond Stimulated X-Ray Raman Spectroscopy (SXRS). J Chem Theory Comput. 2013;9(12)doi: 10.1021/ct400767g.
Hua, W., Biggs, J. D., Zhang, Y., Healion, D., Ren, H., & Mukamel, S. (2013). Multiple Core and Vibronic Coupling Effects in Attosecond Stimulated X-Ray Raman Spectroscopy (SXRS). Journal of chemical theory and computation, 9(12), . https://doi.org/10.1021/ct400767g
Hua, Weijie, et al. "Multiple Core and Vibronic Coupling Effects in Attosecond Stimulated X-Ray Raman Spectroscopy (SXRS)." Journal of chemical theory and computation vol. 9,12 (2013). doi: https://doi.org/10.1021/ct400767g
Hua W, Biggs JD, Zhang Y, Healion D, Ren H, Mukamel S. Multiple Core and Vibronic Coupling Effects in Attosecond Stimulated X-Ray Raman Spectroscopy (SXRS). J Chem Theory Comput. 2013 Dec 10;9(12). doi: 10.1021/ct400767g. PMID: 24376391; PMCID: PMC3870907.
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Spectral lineshapes in nonlinear electronic spectroscopy.

Physical chemistry chemical physics : PCCP

Nenov A, Giussani A, Fingerhut BP, Rivalta I, Dumont E, Mukamel S, Garavelli M.
PMID: 26084213
Phys Chem Chem Phys. 2015 Dec 14;17(46):30925-36. doi: 10.1039/c5cp01167a.

We outline a computational approach for nonlinear electronic spectra, which accounts for the electronic energy fluctuations due to nuclear degrees of freedom and explicitly incorporates the fluctuations of higher excited states, induced by the dynamics in the photoactive state(s)....

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Nenov A, Giussani A, Fingerhut BP, et al. Spectral lineshapes in nonlinear electronic spectroscopy. Phys Chem Chem Phys. 2015;17(46):30925-36doi: 10.1039/c5cp01167a.
Nenov, A., Giussani, A., Fingerhut, B. P., Rivalta, I., Dumont, E., Mukamel, S., & Garavelli, M. (2015). Spectral lineshapes in nonlinear electronic spectroscopy. Physical chemistry chemical physics : PCCP, 17(46), 30925-36. https://doi.org/10.1039/c5cp01167a
Nenov, Artur, et al. "Spectral lineshapes in nonlinear electronic spectroscopy." Physical chemistry chemical physics : PCCP vol. 17,46 (2015): 30925-36. doi: https://doi.org/10.1039/c5cp01167a
Nenov A, Giussani A, Fingerhut BP, Rivalta I, Dumont E, Mukamel S, Garavelli M. Spectral lineshapes in nonlinear electronic spectroscopy. Phys Chem Chem Phys. 2015 Dec 14;17(46):30925-36. doi: 10.1039/c5cp01167a. PMID: 26084213.
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Network Adequacy Standards and Health Insurance--Reply.

JAMA

Haeder SF, Weimer DL, Mukamel DB.
PMID: 26647271
JAMA. 2015 Dec 08;314(22):2415. doi: 10.1001/jama.2015.15076.

No abstract available.

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Haeder SF, Weimer DL, Mukamel DB. Network Adequacy Standards and Health Insurance--Reply. JAMA. 2015;314(22):2415doi: 10.1001/jama.2015.15076.
Haeder, S. F., Weimer, D. L., & Mukamel, D. B. (2015). Network Adequacy Standards and Health Insurance--Reply. JAMA, 314(22), 2415. https://doi.org/10.1001/jama.2015.15076
Haeder, Simon F, et al. "Network Adequacy Standards and Health Insurance--Reply." JAMA vol. 314,22 (2015): 2415. doi: https://doi.org/10.1001/jama.2015.15076
Haeder SF, Weimer DL, Mukamel DB. Network Adequacy Standards and Health Insurance--Reply. JAMA. 2015 Dec 08;314(22):2415. doi: 10.1001/jama.2015.15076. PMID: 26647271.
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Current vs Charge Density Contributions to Nonlinear X-ray Spectroscopy.

Journal of chemical theory and computation

Rouxel JR, Kowalewski M, Mukamel S.
PMID: 27347786
J Chem Theory Comput. 2016 Aug 09;12(8):3959-68. doi: 10.1021/acs.jctc.6b00279. Epub 2016 Jul 19.

Stimulated (coherent) and spontaneous (incoherent) nonlinear X-ray signals are expressed using a spatially nonlocal response tensor which directly connects them to the time evolving current j and charge σ densities rather than to electric and magnetic multipoles. The relative...

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Rouxel JR, Kowalewski M, Mukamel S. Current vs Charge Density Contributions to Nonlinear X-ray Spectroscopy. J Chem Theory Comput. 2016;12(8):3959-68doi: 10.1021/acs.jctc.6b00279.
Rouxel, J. R., Kowalewski, M., & Mukamel, S. (2016). Current vs Charge Density Contributions to Nonlinear X-ray Spectroscopy. Journal of chemical theory and computation, 12(8), 3959-68. https://doi.org/10.1021/acs.jctc.6b00279
Rouxel, Jérémy R, et al. "Current vs Charge Density Contributions to Nonlinear X-ray Spectroscopy." Journal of chemical theory and computation vol. 12,8 (2016): 3959-68. doi: https://doi.org/10.1021/acs.jctc.6b00279
Rouxel JR, Kowalewski M, Mukamel S. Current vs Charge Density Contributions to Nonlinear X-ray Spectroscopy. J Chem Theory Comput. 2016 Aug 09;12(8):3959-68. doi: 10.1021/acs.jctc.6b00279. Epub 2016 Jul 19. PMID: 27347786.
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Turning over DNA methylation in the mind.

Frontiers in neuroscience

Lister R, Mukamel EA.
PMID: 26283895
Front Neurosci. 2015 Jul 30;9:252. doi: 10.3389/fnins.2015.00252. eCollection 2015.

Cytosine DNA methylation is a stable epigenetic modification with established roles in regulating transcription, imprinting, female X-chromosome inactivation, and silencing of transposons. Dynamic gain or loss of DNA methylation reshapes the genomic landscape of cells during early differentiation, and...

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Lister R, Mukamel EA. Turning over DNA methylation in the mind. Front Neurosci. 2015;9:252doi: 10.3389/fnins.2015.00252.
Lister, R., & Mukamel, E. A. (2015). Turning over DNA methylation in the mind. Frontiers in neuroscience, 9252. https://doi.org/10.3389/fnins.2015.00252
Lister, Ryan, and Mukamel, Eran A. "Turning over DNA methylation in the mind." Frontiers in neuroscience vol. 9 (2015): 252. doi: https://doi.org/10.3389/fnins.2015.00252
Lister R, Mukamel EA. Turning over DNA methylation in the mind. Front Neurosci. 2015 Jul 30;9:252. doi: 10.3389/fnins.2015.00252. eCollection 2015. PMID: 26283895; PMCID: PMC4519686.
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Response to "Comment on 'Frequency-domain stimulated and spontaneous light emission signals at molecular junctions'" [J. Chem. Phys. 142, 137101 (2015)].

The Journal of chemical physics

Harbola U, Agarwalla BK, Mukamel S.
PMID: 25854262
J Chem Phys. 2015 Apr 07;142(13):137102. doi: 10.1063/1.4916524.

No abstract available.

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Harbola U, Agarwalla BK, Mukamel S. Response to "Comment on 'Frequency-domain stimulated and spontaneous light emission signals at molecular junctions'" [J. Chem. Phys. 142, 137101 (2015)]. J Chem Phys. 2015;142(13):137102doi: 10.1063/1.4916524.
Harbola, U., Agarwalla, B. K., & Mukamel, S. (2015). Response to "Comment on 'Frequency-domain stimulated and spontaneous light emission signals at molecular junctions'" [J. Chem. Phys. 142, 137101 (2015)]. The Journal of chemical physics, 142(13), 137102. https://doi.org/10.1063/1.4916524
Harbola, Upendra, et al. "Response to "Comment on 'Frequency-domain stimulated and spontaneous light emission signals at molecular junctions'" [J. Chem. Phys. 142, 137101 (2015)]." The Journal of chemical physics vol. 142,13 (2015): 137102. doi: https://doi.org/10.1063/1.4916524
Harbola U, Agarwalla BK, Mukamel S. Response to "Comment on 'Frequency-domain stimulated and spontaneous light emission signals at molecular junctions'" [J. Chem. Phys. 142, 137101 (2015)]. J Chem Phys. 2015 Apr 07;142(13):137102. doi: 10.1063/1.4916524. PMID: 25854262.
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Nonadiabatic Dynamics May Be Probed through Electronic Coherence in Time-Resolved Photoelectron Spectroscopy.

Journal of chemical theory and computation

Bennett K, Kowalewski M, Mukamel S.
PMID: 26691822
J Chem Theory Comput. 2016 Feb 09;12(2):740-52. doi: 10.1021/acs.jctc.5b00824. Epub 2016 Jan 08.

We present a hierarchy of Fermi golden rules (FGRs) that incorporate strongly coupled electronic/nuclear dynamics in time-resolved photoelectron spectroscopy (TRPES) signals at different levels of theory. Expansion in the joint electronic and nuclear eigenbasis yields the numerically most challenging...

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Bennett K, Kowalewski M, Mukamel S. Nonadiabatic Dynamics May Be Probed through Electronic Coherence in Time-Resolved Photoelectron Spectroscopy. J Chem Theory Comput. 2016;12(2):740-52doi: 10.1021/acs.jctc.5b00824.
Bennett, K., Kowalewski, M., & Mukamel, S. (2016). Nonadiabatic Dynamics May Be Probed through Electronic Coherence in Time-Resolved Photoelectron Spectroscopy. Journal of chemical theory and computation, 12(2), 740-52. https://doi.org/10.1021/acs.jctc.5b00824
Bennett, Kochise, et al. "Nonadiabatic Dynamics May Be Probed through Electronic Coherence in Time-Resolved Photoelectron Spectroscopy." Journal of chemical theory and computation vol. 12,2 (2016): 740-52. doi: https://doi.org/10.1021/acs.jctc.5b00824
Bennett K, Kowalewski M, Mukamel S. Nonadiabatic Dynamics May Be Probed through Electronic Coherence in Time-Resolved Photoelectron Spectroscopy. J Chem Theory Comput. 2016 Feb 09;12(2):740-52. doi: 10.1021/acs.jctc.5b00824. Epub 2016 Jan 08. PMID: 26691822.
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Criterion for phase separation in one-dimensional driven systems.

Physical review letters

Kafri Y, Levine E, Mukamel D, Schütz GM, Török J.
PMID: 12144403
Phys Rev Lett. 2002 Jul 15;89(3):035702. doi: 10.1103/PhysRevLett.89.035702. Epub 2002 Jun 27.

A general criterion for the existence of phase separation in driven density-conserving one-dimensional systems is proposed. It is suggested that phase separation is related to the size dependence of the steady-state currents of domains in the system. A quantitative...

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Kafri Y, Levine E, Mukamel D, et al. Criterion for phase separation in one-dimensional driven systems. Phys Rev Lett. 2002;89(3):035702doi: 10.1103/PhysRevLett.89.035702.
Kafri, Y., Levine, E., Mukamel, D., Schütz, G. M., & Török, J. (2002). Criterion for phase separation in one-dimensional driven systems. Physical review letters, 89(3), 035702. https://doi.org/10.1103/PhysRevLett.89.035702
Kafri, Y, et al. "Criterion for phase separation in one-dimensional driven systems." Physical review letters vol. 89,3 (2002): 035702. doi: https://doi.org/10.1103/PhysRevLett.89.035702
Kafri Y, Levine E, Mukamel D, Schütz GM, Török J. Criterion for phase separation in one-dimensional driven systems. Phys Rev Lett. 2002 Jul 15;89(3):035702. doi: 10.1103/PhysRevLett.89.035702. Epub 2002 Jun 27. PMID: 12144403.
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Surface states in nearly modulated systems.

Physical review. E, Statistical, nonlinear, and soft matter physics

Jacobs AE, Mukamel D, Allender DW.
PMID: 11308507
Phys Rev E Stat Nonlin Soft Matter Phys. 2001 Feb;63(2):021704. doi: 10.1103/PhysRevE.63.021704. Epub 2001 Jan 23.

A Landau model is used to study the phase behavior of the surface layer for magnetic and cholesteric liquid-crystal systems that are at or near a Lifshitz point marking the boundary between modulated and homogeneous bulk phases. The model...

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Jacobs AE, Mukamel D, Allender DW. Surface states in nearly modulated systems. Phys Rev E Stat Nonlin Soft Matter Phys. 2001;63(2):021704doi: 10.1103/PhysRevE.63.021704.
Jacobs, A. E., Mukamel, D., & Allender, D. W. (2001). Surface states in nearly modulated systems. Physical review. E, Statistical, nonlinear, and soft matter physics, 63(2), 021704. https://doi.org/10.1103/PhysRevE.63.021704
Jacobs, A E, et al. "Surface states in nearly modulated systems." Physical review. E, Statistical, nonlinear, and soft matter physics vol. 63,2 (2001): 021704. doi: https://doi.org/10.1103/PhysRevE.63.021704
Jacobs AE, Mukamel D, Allender DW. Surface states in nearly modulated systems. Phys Rev E Stat Nonlin Soft Matter Phys. 2001 Feb;63(2):021704. doi: 10.1103/PhysRevE.63.021704. Epub 2001 Jan 23. PMID: 11308507.
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Density matrix analysis and simulation of electronic excitations in conjugated and aggregated molecules.

Chemical reviews

Tretiak S, Mukamel S.
PMID: 12222985
Chem Rev. 2002 Sep;102(9):3171-212. doi: 10.1021/cr0101252.

No abstract available.

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Tretiak S, Mukamel S. Density matrix analysis and simulation of electronic excitations in conjugated and aggregated molecules. Chem Rev. 2002;102(9):3171-212doi: 10.1021/cr0101252.
Tretiak, S., & Mukamel, S. (2002). Density matrix analysis and simulation of electronic excitations in conjugated and aggregated molecules. Chemical reviews, 102(9), 3171-212. https://doi.org/10.1021/cr0101252
Tretiak, Sergei, and Mukamel, Shaul. "Density matrix analysis and simulation of electronic excitations in conjugated and aggregated molecules." Chemical reviews vol. 102,9 (2002): 3171-212. doi: https://doi.org/10.1021/cr0101252
Tretiak S, Mukamel S. Density matrix analysis and simulation of electronic excitations in conjugated and aggregated molecules. Chem Rev. 2002 Sep;102(9):3171-212. doi: 10.1021/cr0101252. PMID: 12222985.
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Showing 1 to 12 of 350 entries