메뉴 건너뛰기




Volumn 134, Issue 21, 2011, Pages

Damped response theory description of two-photon absorption

Author keywords

[No Author keywords available]

Indexed keywords

DENSITY MATRIX FORMULATIONS; FREQUENCY RANGES; HIGH DENSITY; INTERMEDIATE STATE; LARGE SYSTEM; RESPONSE FUNCTIONS; RESPONSE THEORY; STANDARD THEORIES; TWO-PHOTON ABSORPTION SPECTRUM; TWO-PHOTON ABSORPTIONS;

EID: 79958827841     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3595280     Document Type: Article
Times cited : (46)

References (97)
  • 9
    • 0035830266 scopus 로고    scopus 로고
    • Near-resonant absorption in the time-dependent self-consistent field and multiconfigurational self-consistent field approximations
    • DOI 10.1063/1.1415081
    • P. Norman, D. M. Bishop, H. J. A. Jensen, and J. Oddershede, J. Chem. Phys. 115, 10323 (2001). 10.1063/1.1415081 (Pubitemid 34061139)
    • (2001) Journal of Chemical Physics , vol.115 , Issue.22 , pp. 10323-10334
    • Norman, P.1    Bishop, D.M.2    Jensen, H.J.Aa.3    Oddershede, J.4
  • 13
    • 1842531892 scopus 로고    scopus 로고
    • 10.1103/PhysRevB.69.085111
    • X. Blase and P. Ordejn, Phys. Rev. B 69, 085111 (2004). 10.1103/PhysRevB.69.085111
    • (2004) Phys. Rev. B , vol.69 , pp. 085111
    • Blase, X.1    Ordejn, P.2
  • 14
    • 20544466926 scopus 로고    scopus 로고
    • Finite lifetime effects on the polarizability within time-dependent density-functional theory
    • DOI 10.1063/1.1929740, 224115
    • L. Jensen, J. Autschbach, and G. C. Schatz, J. Chem. Phys. 122, 224115 (2005). 10.1063/1.1929740 (Pubitemid 40844866)
    • (2005) Journal of Chemical Physics , vol.122 , Issue.22 , pp. 1-11
    • Jensen, L.1    Autschbach, J.2    Schatz, G.C.3
  • 18
    • 34047276121 scopus 로고    scopus 로고
    • Electronic circular dichroism spectra from the complex polarization propagator
    • DOI 10.1063/1.2716660
    • A. Jiemchooroj and P. Norman, J. Chem. Phys. 126, 134102 (2007). 10.1063/1.2716660 (Pubitemid 46550222)
    • (2007) Journal of Chemical Physics , vol.126 , Issue.13 , pp. 134102
    • Jiemchooroj, A.1    Norman, P.2
  • 20
    • 33746297347 scopus 로고    scopus 로고
    • Calculation of origin-independent optical rotation tensor components in approximate time-dependent density functional theory
    • DOI 10.1063/1.2210474
    • M. Krykunov and J. Autschbach, J. Chem. Phys. 125, 034102 (2006). 10.1063/1.2210474 (Pubitemid 44107126)
    • (2006) Journal of Chemical Physics , vol.125 , Issue.3 , pp. 034102
    • Krykunov, M.1    Autschbach, J.2
  • 21
    • 33845286924 scopus 로고    scopus 로고
    • Calculation of circular dichroism spectra from optical rotatory dispersion, and vice versa, as complementary tools for theoretical studies of optical activity using time-dependent density functional theory
    • DOI 10.1063/1.2363372
    • M. Krykunov, M. D. Kundrat, and J. Autschbach, J. Chem. Phys. 125, 194110 (2006). 10.1063/1.2363372 (Pubitemid 44867323)
    • (2006) Journal of Chemical Physics , vol.125 , Issue.19 , pp. 194110
    • Krykunov, M.1    Kundrat, M.D.2    Autschbach, J.3
  • 22
  • 25
    • 36049044738 scopus 로고    scopus 로고
    • Near-edge x-ray absorption and natural circular dichroism spectra of L-alanine: A theoretical study based on the complex polarization propagator approach
    • DOI 10.1063/1.2800024
    • A. Jiemchooroj, U. Ekstrm, and P. Norman, J. Chem. Phys. 127, 165104 (2007). 10.1063/1.2800024 (Pubitemid 350094901)
    • (2007) Journal of Chemical Physics , vol.127 , Issue.16 , pp. 165104
    • Jiemchooroj, A.1    Ekstrom, U.2    Norman, P.3
  • 28
    • 33846233082 scopus 로고    scopus 로고
    • Calculation of static and dynamic linear magnetic response in approximate time-dependent density functional theory
    • DOI 10.1063/1.2423007
    • M. Krykunov and J. Autschbach, J. Chem. Phys. 126, 024101 (2007). 10.1063/1.2423007 (Pubitemid 46105647)
    • (2007) Journal of Chemical Physics , vol.126 , Issue.2 , pp. 024101
    • Krykunov, M.1    Autschbach, J.2
  • 31
    • 27644564718 scopus 로고    scopus 로고
    • Theory and method for calculating resonance Raman scattering from resonance polarizability derivatives
    • DOI 10.1063/1.2046670, 174110
    • L. Jensen, L. L. Zhao, J. Autschbach, and G. C. Schatz, J. Chem. Phys. 123, 174110 (2005). 10.1063/1.2046670 (Pubitemid 41567398)
    • (2005) Journal of Chemical Physics , vol.123 , Issue.17 , pp. 1-11
    • Jensen, L.1    Zhao, L.L.2    Autschbach, J.3    Schatz, G.C.4
  • 32
    • 33745748486 scopus 로고    scopus 로고
    • 20 nanoclusters
    • DOI 10.1021/nl0607378
    • L. L. Zhao, L. Jensen, and G. C. Schatz, Nano Lett. 6, 1229 (2006). 10.1021/nl0607378 (Pubitemid 44013487)
    • (2006) Nano Letters , vol.6 , Issue.6 , pp. 1229-1234
    • Zhao, L.L.1    Jensen, L.2    Schatz, G.C.3
  • 35
    • 33744787335 scopus 로고    scopus 로고
    • Resonance Raman scattering of rhodamine 6G as calculated using time-dependent density functional theory
    • DOI 10.1021/jp0610867
    • L. Jensen and G. C. Schatz, J. Phys. Chem. A 110, 5973 (2006). 10.1021/jp0610867 (Pubitemid 43829036)
    • (2006) Journal of Physical Chemistry A , vol.110 , Issue.18 , pp. 5973-5977
    • Jensen, L.1    Schatz, G.C.2
  • 36
    • 34948825487 scopus 로고    scopus 로고
    • Resonance vibrational Raman optical activity: A time-dependent density functional theory approach
    • DOI 10.1063/1.2768533
    • L. Jensen, J. Autschbach, M. Krykunov, and G. C. Schatz, J. Chem. Phys. 127, 134101 (2007). 10.1063/1.2768533 (Pubitemid 47531597)
    • (2007) Journal of Chemical Physics , vol.127 , Issue.13 , pp. 134101
    • Jensen, L.1    Autschbach, J.2    Krykunov, M.3    Schatz, G.C.4
  • 43
    • 40549122350 scopus 로고    scopus 로고
    • Complex polarization propagator calculations of magnetic circular dichroism spectra
    • DOI 10.1063/1.2834924
    • H. Solheim, K. Ruud, S. Coriani, and P. Norman, J. Chem. Phys. 128, 094103 (2008). 10.1063/1.2834924 (Pubitemid 351357782)
    • (2008) Journal of Chemical Physics , vol.128 , Issue.9 , pp. 094103
    • Solheim, H.1    Ruud, K.2    Coriani, S.3    Norman, P.4
  • 48
    • 84967678516 scopus 로고
    • 10.1002/and19314010303
    • M. Geppert-Mayer, Ann. Phys. 9, 273 (1931). 10.1002/andp.19314010303
    • (1931) Ann. Phys. , vol.9 , pp. 273
    • Geppert-Mayer, M.1
  • 50
    • 21544457381 scopus 로고
    • 10.1103/PhysRevLett.9.453
    • I. D. Abella, Phys. Rev. Lett. 9, 453 (1962). 10.1103/PhysRevLett.9.453
    • (1962) Phys. Rev. Lett. , vol.9 , pp. 453
    • Abella, I.D.1
  • 58
    • 43149084618 scopus 로고    scopus 로고
    • Multiphoton absorbing materials: Molecular designs, characterizations, and applications
    • DOI 10.1021/cr050054x
    • G. S. He, L.-S. Tan, Q. Zheng, and P. N. Prasad, Chem. Rev. 108, 1245 (2008). 10.1021/cr050054x (Pubitemid 351638815)
    • (2008) Chemical Reviews , vol.108 , Issue.4 , pp. 1245-1330
    • He, G.S.1    Tan, L.-S.2    Zheng, Q.3    Prasad, P.N.4
  • 60
    • 36149045167 scopus 로고
    • 10.1088/0022-3700/18/16/017
    • R. Moccia and A. Rizzo, J. Phys. B 18, 3319 (1985). 10.1088/0022-3700/18/ 16/017
    • (1985) J. Phys. B , vol.18 , pp. 3319
    • Moccia, R.1    Rizzo, A.2
  • 61
  • 63
    • 0002301098 scopus 로고    scopus 로고
    • Density functional theory of time-dependent phenomena
    • in (Springer, New York), Vol.
    • E. K. U. Gross, J. F. Dobson, and M. Petersilka, Density functional theory of time-dependent phenomena., in Topics in Current Chemistry (Springer, New York, 1996), Vol. 81.
    • (1996) Topics in Current Chemistry , vol.81
    • Gross, E.K.U.1    Dobson, J.F.2    Petersilka, M.3
  • 73
    • 84961978615 scopus 로고    scopus 로고
    • 10.3390/molecules16043315
    • F. E. Hernndez and A. Rizzo, Molecules 16, 3315 (2011). 10.3390/molecules16043315
    • (2011) Molecules , vol.16 , pp. 3315
    • Hernndez, F.E.1    Rizzo, A.2
  • 74
    • 0000823007 scopus 로고
    • 10.1063/1.430566
    • I. Tinoco, Jr., J. Chem. Phys. 62, 1006 (1975). 10.1063/1.430566
    • (1975) J. Chem. Phys. , vol.62 , pp. 1006
    • Tinoco, Jr.I.1
  • 75
    • 25844432287 scopus 로고    scopus 로고
    • Response theory calculations of two-photon circular dichroism
    • DOI 10.1016/j.cplett.2005.08.114, PII S0009261405012443
    • B. Jansk, A. Rizzo, and H. gren, Chem. Phys. Lett. 414, 461 (2005). 10.1016/j.cplett.2005.08.114 (Pubitemid 41393652)
    • (2005) Chemical Physics Letters , vol.414 , Issue.4-6 , pp. 461-467
    • Jansik, B.1    Rizzo, A.2    Agren, H.3
  • 83
  • 87
    • 12344338341 scopus 로고    scopus 로고
    • Theoretical investigation of 1,1′-bi-2-naphthol isomerization
    • DOI 10.1016/j.molstruc.2004.11.041, PII S0022286004009305
    • R. Sahnoun, S. Koseki, and Y. Fujimura, J. Mol. Struct. 735-736, 315 (2005). 10.1016/j.molstruc.2004.11.041 (Pubitemid 40126567)
    • (2005) Journal of Molecular Structure , vol.735-736 , Issue.SPEC. ISS. , pp. 315-324
    • Sahnoun, R.1    Koseki, S.2    Fujimura, Y.3
  • 88
    • 0000189651 scopus 로고
    • 10.1063/1.464913
    • A. D. Becke, J. Chem. Phys. 98, 5648 (1993). 10.1063/1.464913
    • (1993) J. Chem. Phys. , vol.98 , pp. 5648
    • Becke, A.D.1
  • 89
    • 4243553426 scopus 로고
    • 10.1103/PhysRevA.38.3098
    • A. D. Becke, Phys. Rev. A 38, 3098 (1988). 10.1103/PhysRevA.38.3098
    • (1988) Phys. Rev. A , vol.38 , pp. 3098
    • Becke, A.D.1
  • 90
  • 91
    • 79958796343 scopus 로고    scopus 로고
    • DALTON Release 2.0, an ab initio electronic structure program, see
    • DALTON Release 2.0, an ab initio electronic structure program, 2005, see http://www.kjemi.uio.no/software/dalton/dalton.html.
    • (2005)
  • 94
  • 95
    • 5344230920 scopus 로고
    • 10.1016/0021-9991(75)90065-0
    • E. R. Davidson, J. Comput. Phys. 17, 87 (1975). 10.1016/0021-9991(75) 90065-0
    • (1975) J. Comput. Phys. , vol.17 , pp. 87
    • Davidson, E.R.1


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.