Difference between revisions of "Publications using SALMON"
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*[Molecule] [NC6N] [Optical Near Field] <br / > T. Iwasa and K. Nobusada, "Nonuniform light-matter interaction theory for near-field-induced electron dynamics <br / > '' Phys. Rev''. ''' A 80''' 043409 (2009) | *[Molecule] [NC6N] [Optical Near Field] <br / > T. Iwasa and K. Nobusada, "Nonuniform light-matter interaction theory for near-field-induced electron dynamics <br / > '' Phys. Rev''. ''' A 80''' 043409 (2009) | ||
<br / > http://dx.doi.org/10.1103/PhysRevA.80.043409 | <br / > http://dx.doi.org/10.1103/PhysRevA.80.043409 | ||
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+ | *[Molecule] [C60] [Linear Response] <br / > Y. Kawashita, K. Yabana, M. Noda, K. Nobusada and T. Nakatsukasa <br / > Oscillator Strength Distribution of C60 in the Time-Dependent Density Functional Theory <br / > ''J. Mol. Struct.: Theochem'' '''914,''' 130 (2009) <br / > http://dx.doi.org/10.1016/j.theochem.2009.04.022 |
Revision as of 15:06, 28 August 2017
Published papers that use SALMON will be useful to know what SALMON can do. We list papers that uses SALMON and its former programs including GCEED developed in Institute of Molecular Science and ARTED developed in University of Tsukuba. If you publish a paper using SALMON and the paper does not appear here, please let us know of it.
2017
- [Nanostructure] [Acetylene/IRMOF-10] [Optical near field]
M. Noda, M. Yamaguchi and K. Nobusada,
Second Harmonic Excitation of Acetylene by the Optical Near Field Generated in a Porous Material
J. Phys. Chem. C 121, 11687 (2017)
http://dx.doi.org/10.1021/acs.jpcc.7b0274
- [Interface] [SiO2–graphene–boron nitride] [Bias Voltage]
K. Iida, M. Noda and K. Nobusada,
Development of Theoretical Approach for Describing Electronic Properties of Hetero-Interface Systems under Applied Bias Voltage
J. Chem. Phys. 146, 084706 (2017)
http://dx.doi.org/10.1063/1.4976970
2016
- [Solid][Diamond][Attosecond]
M. Lucchini, S.A. Sato, A. Ludwig, J. Herrmann, M. Volkov, L. Kasmi, Y. Shinohara, K. Yabana, L. Gallmann, U. Keller
Attosecond dynamical Franz-Keldysh effect in polycrystalline diamond
Science 353, 916-919 (2016).
DOI: 10.1126/science.aag1268
- [Solid][SiO2][Attosecond]
A. Sommer, E.M. Bothschafter, S.A. Sato, C. Jakubeit, T. Latka, O. Razskazovskaya,H. Fattahi, M. Jobst, W. Schweinberger, V. Shirvanyan, V.S. Yakovlev, R. Kienberger, K. Yabana, N. Karpowicz, M. Schultze, F. Krausz
Attosecond nonlinear polarization and light-matter energy transfer in solids
Nature 534, 86-90 (2016).
DOI:10.1038/nature17650
- [Molecule] [Para-Dinitrobenzene, Paranitroaniline] [Optical Near Field]
M. Yamaguchi and K. Nobusada,
Large Hyperpolarizabilities of the Second Harmonic Generation Induced by Nonuniform Optical Near Fields
J. Phys. Chem. C 120, 23748 (2016)
http://dx.doi.org/10.1021/acs.jpcc.6b08507
- [Interface] [Silicene–amine] [Electric Field Bias]
K. Iida and K. Nobusada
Electric field effects on the electronic properties of the silicene-amine interface
Phys. Chem. Chem. Phys. 18, 15639 (2016)
http://dx.doi.org/10.1039/c6cp02157c
- [Cluster] [Au133(SPhtBu)52] [Linear Response]
K. Iida, M. Noda and K. Nobusada
Interface Electronic Properties Between a Gold Core and Thiolate Ligands: Effects on an Optical Absorption Spectrum in Au133(SPh-tBu)52
J. Phys. Chem. C 120, 2753 (2016)
http://dx.doi.org/10.1021/acs.jpcc.5b1084
2015
- [Solid][Diamond][Nonlinear Optics]
T. Otobe, Y. Shinohara, S.A. Sato, K. Yabana
Femtosecond time-resolved dynamical Franz-Keldysh effect
Phys. Rev. B93, 045124 (2016).
arXiv:1504.01458
DOI: 10.1103/PhysRevB.93.045124
- [Solid][SiO2][Optical Current]
G. Wachter, S.A. Sato, C. Lemell, X.M. Tong, K. Yabana, J. Burgdoerfer
Controlling ultrafast currents by the non-linear photogalvanic effect
New J. Phys. 17, 123026 (2015).
arXiv:1503.06146
DOI: 10.1088/1367-2630/17/12/123026
- [Molecule][Endohedral Fullerene][Attosecond]
G. Wachter, S. Nagele, S.A. Sato, R. Pazourek, M. Wais, C. Lemell, X.-M. Tong, K. Yabana, J. Burgdoerfer
Protocol for observing molecular dipole excitations by attosecond self-streaking
Phys. Rev. A92, 061403(R)
arXiv:1505.05857 )
DOI: 10.1103/PhysRevA.92.061403
- [Solid][Silicon, Germanium][Linear Response, Nonlinear Optics]
S.A. Sato, Y. Taniguchi, Y. Shinohara, K. Yabana
Nonlinear electronic excitations in crystalline solids using meta-generalized gradient approximation and hybrid functional in time-dependent density functional theory
J. Chem. Phys. 143, 224116 (2015)
arXiv:1507.05156
DOI: 10.1063/1.4937379
- [Solid][SiO2][Laser Damage]
S.A. Sato, K. Yabana, Y. Shinohara, T. Otobe, K.M. Lee, G.F. Bertsch
Time-dependent density functional theory of high-intensity, short-pulse laser irradiation on insulators
Phys. Rev. B92 205413 (6 pages) (2015).
arXiv: 1412.1445
DOI: 10.1103/PhysRevB.92.205413
- [Interface] [Ag Cluster/Dielectric Surface] [Electronic Structure, Linear Response]
K. Iida, M. Noda and K. Nobusada
Control of Optical Response of a Supported Cluster on Different Dielectric Substrates
J. Chem. Phys. 142 214702 (2015)
http://dx.doi.org/10.1063/1.4921840
2014
- [Solid][Silicon][Attosecond]
M. Schultze, K. Ramasesha, C.D. Pemmaraju, S.A. Sato, D. Whitmore, A. Gandman, J.S. Prell, L.J. Borja, D. Prendergast, K. Yabana, D.M. Neumark, S.R. Leone
Attosecond band-gap dynamics in silicon
Science 346(6215), 1348-1352 (2014).
DOI: 10.1126/science.1260311
- [Solid][Silicon][Nonlinear Optics]
S.A. Sato, Y. Shinohara, T. Otobe, K. Yabana
Dielectric response of laser-excited silicon at finite electron temperature
Phys. Rev. B.90(17), 174303 (8 pages) (2014).
DOI: 10.1103/PhysRevB.90.174303
- [Algorithm]
S.A. Sato, K. Yabana
Maxwell+TDDFT multi-scale simulation for laser-matter interactions
J. Adv. Simulat. Sci. Eng. 1(1), 98-110 (2014).
DOI: 10.15748/jasse.1.98
- [Solid][SiO2][Optical Current]
G. Wachter, C. Lemell, J. Burgdoerfer, S.A. Sato, X.-M. Tong, K. Yabana
Ab Initio Simulation of Electrical Currents Induced by Ultrafast Laser Excitation of Dielectric Materials
Phys. Rev. Lett. 113(8), 087401 (5 pages) (2014).
arXiv:1401.4357
DOI: 10.1103/PhysRevLett.113.087401
- [Solid][SiO2][Nonlinear Optics]
S.A. Sato, K. Yabana
Efficient basis expansion for describing linear and nonlinear electron dynamics in crystalline solids
Phys. Rev. B 89(22), 224305 (11 pages) (2014).
DOI: 10.1103/PhysRevB.89.224305
- [Cluster] [Aun (n = 54, 146, 308, 560, 922, 1414)] [Plasmon]
K. Iida, M. Noda, K. Ishimura and K. Nobusada
First-Principles Computational Visualization of Localized Surface Plasmon Resonance in Gold Nanoclusters
J. Phys. Chem. A 118, 11317 (2014)
http://dx.doi.org/10.1021/jp5088042
- [Interface] [4-mercaptopyridine/Ag Electrode] [Raman]
K. Iida, M. Noda and K. Nobusada
Theoretical Approach for Optical Response in Electrochemical Systems: Application to Electrode Potential Dependence of Surface-Enhanced-Raman Scattering
J. Chem. Phys. 141, 124124 (2014)
http://dx.doi.org/10.1063/1.4896537
- [Algorithm] [Nanostructure] [C60 Array]
M. Noda, K. Ishimura, K. Nobusada, K. Yabana and T. Boku
Massively-Parallel Electron Dynamics Calculations in Real-time and Real-Space: Toward Applications to Nanostructures of more than Ten-Nanometers in Size
J. Comp. Phys. 265, 145 (2014)
http://dx.doi.org/10.1016/j.jcp.2014.02.006
2013
- [Solid][Silicon][Nonlinear Optics]
S.A. Sato, K. Yabana, Y. Shinohara, T. Otobe, G.F. Bertsch
Numerical pump-probe experiments of laser-excited silicon in nonequilibrium phase
Phys. Rev. B 89(6), 064304 (8 pages) (2014).
arXiv:1303.3249
DOI: 10.1103/PhysRevB.89.064304
- [Solid][SiO2][Laser Damage]
K.-M. Lee, C.M. Kim, S.A. Sato, T. Otobe, Y. Shinohara, K. Yabana, T.M. Jeong
First-principles simulation of the optical response of bulk and thin-film α-quartz irradiated with an ultrashort intense laser pulse
J. Appl. Phys. 115(5), 053519 (8 pages) (2014).
DOI: 10.1063/1.4864662
2012
- [Solid][Sb][Coherent Phonon]
Y. Shinohara, S.A. Sato, K. Yabana, J.-I. Iwata, T. Otobe, G.F. Bertsch
Nonadiabatic generation of coherent phonons
J. Chem. Phys. 137(22), 22A527 (8 pages) (2012).
DOI: 10.1063/1.4739844
- [Molecule] [Pyrazine/Na4] [Raman]
M. Noda, T. Yasuike, K. Nobusada and M. Hayashi
Enhanced Raman spectrum of pyrazine with the aid of resonant electron dynamics in a nearby cluster
Chem. Phys. Lett. 550, 52 (2012)
http://dx.doi.org/10.1016/j.cplett.2012.08.059
2011
- [Solid][Silicon][Nonlinear Optics]
K. Yabana, T. Sugiyama, Y. Shinohara, T. Otobe, G.F. Bertsch
Time-dependent density functional theory for strong electromagnetic fields in crystalline solids
Phys. Rev. B85(4), 045134 (11 pages) (2012).
DOI: 10.1103/PhysRevB.85.045134
- [Molecule][Inorganic][MCD]
K.-M. Lee, K. Yabana, G.F. Bertsch
Magnetic circular dichroism in real-time time-dependent density functional theory
J. Chem. Phys. 134(14), 144106 (9 pages) (2011).
DOI: 10.1063/1.3575587
- [Surface] [Cs/Cu(111)] [Linear Response]
T. Yasuike and K. Nobusada
Open-boundary cluster model implemented in first-principles calculations for electronic excited states of an adsorbate-surface system
Phys. Rev. B 84, 245408 (2011)
http://dx.doi.org/10.1103/PhysRevB.84.245408
2010
- [Molecule] [C60] [Optical Near Field]
T. Iwasa and K. Nobusada
Near-field-induced optical force on a metal particle and C60: Real-time and real-space electron dynamics simulation
Phys. Rev. A 82, 043411 (2010)
http://dx.doi.org/10.1103/PhysRevA.82.043411
2009
- [Molecule] [NC6N] [Optical Near Field]
T. Iwasa and K. Nobusada, "Nonuniform light-matter interaction theory for near-field-induced electron dynamics
Phys. Rev. A 80 043409 (2009)
http://dx.doi.org/10.1103/PhysRevA.80.043409
- [Molecule] [C60] [Linear Response]
Y. Kawashita, K. Yabana, M. Noda, K. Nobusada and T. Nakatsukasa
Oscillator Strength Distribution of C60 in the Time-Dependent Density Functional Theory
J. Mol. Struct.: Theochem 914, 130 (2009)
http://dx.doi.org/10.1016/j.theochem.2009.04.022