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Volumn 82, Issue 5, 2006, Pages 1136-1160

Overview of theoretical and computational methods applied to the oxygen-organic molecule photosystem

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EID: 33750733998     PISSN: 00318655     EISSN: None     Source Type: Journal    
DOI: 10.1562/2006-03-17-IR-851     Document Type: Conference Paper
Times cited : (107)

References (162)
  • 2
    • 0013504214 scopus 로고
    • Theoretical calculations of singlet oxygen reactions
    • (Edited by A. A. Frimer), CRC Press, Boca Raton, FL
    • Yamaguchi, K. (1985) Theoretical calculations of singlet oxygen reactions. In Singlet Oxygen, Vol. 3 (Edited by A. A. Frimer), pp. 119-251. CRC Press, Boca Raton, FL.
    • (1985) Singlet Oxygen , vol.3 , pp. 119-251
    • Yamaguchi, K.1
  • 3
    • 33749333894 scopus 로고
    • Interpretation of the atmospheric oxygen bands; electronic levels of the oxygen molecule
    • Mulliken, R. S. (1928) Interpretation of the atmospheric oxygen bands; electronic levels of the oxygen molecule. Nature 122, 505.
    • (1928) Nature , vol.122 , pp. 505
    • Mulliken, R.S.1
  • 4
    • 0001830002 scopus 로고
    • Interpretation of band spectra. III. Electron quantum numbers and states of molecules and their atoms
    • Mulliken, R. S. (1932) Interpretation of band spectra. III. Electron quantum numbers and states of molecules and their atoms. Rev. Mod. Phys. 4, 1-86.
    • (1932) Rev. Mod. Phys. , vol.4 , pp. 1-86
    • Mulliken, R.S.1
  • 7
    • 0002454460 scopus 로고
    • Singlet oxygen electronic structure and photosensitization
    • (Edited by H. H. Wasserman and R. W. Murray), Academic Press, New York
    • Kasha, M. and D. E. Brabham (1979) Singlet oxygen electronic structure and photosensitization. In Singlet Oxygen (Edited by H. H. Wasserman and R. W. Murray), pp. 1-33. Academic Press, New York.
    • (1979) Singlet Oxygen , pp. 1-33
    • Kasha, M.1    Brabham, D.E.2
  • 9
    • 33947291445 scopus 로고
    • Physical and chemical properties of singlet molecular oxygen
    • Kearns, D. R. (1971) Physical and chemical properties of singlet molecular oxygen. Chem. Rev. 71, 395-427.
    • (1971) Chem. Rev. , vol.71 , pp. 395-427
    • Kearns, D.R.1
  • 12
    • 0033449808 scopus 로고    scopus 로고
    • Calculations on open shell molecules: A beginner's guide
    • Bally, T. and W. T. Borden (1999) Calculations on open shell molecules: A beginner's guide. Rev. Comput. Chem. 13, 1-97.
    • (1999) Rev. Comput. Chem. , vol.13 , pp. 1-97
    • Bally, T.1    Borden, W.T.2
  • 17
    • 16144366604 scopus 로고    scopus 로고
    • On the inherent divergence in the Møller-Plesset series. The neon atom - A test case
    • Christiansen, O., J. Olsen, P. Jørgensen, H. Koch and P.-Å. Malmqvist (1996) On the inherent divergence in the Møller-Plesset series. The neon atom - A test case. Chem. Phys. Lett. 261, 369-378.
    • (1996) Chem. Phys. Lett. , vol.261 , pp. 369-378
    • Christiansen, O.1    Olsen, J.2    Jørgensen, P.3    Koch, H.4    Malmqvist, P.-Å.5
  • 18
    • 0000119421 scopus 로고    scopus 로고
    • Surprising cases of divergent behavior in Møller-Plesset perturbation theory
    • Olsen, J., O. Christiansen, H. Koch and P. Jørgensen (1996) Surprising cases of divergent behavior in Møller-Plesset perturbation theory. J. Chem. Phys. 105, 5082-5090.
    • (1996) J. Chem. Phys. , vol.105 , pp. 5082-5090
    • Olsen, J.1    Christiansen, O.2    Koch, H.3    Jørgensen, P.4
  • 19
    • 0033692079 scopus 로고    scopus 로고
    • Divergence in Møller-Plesset theory: A simple explanation based on a two-state model
    • Olsen, J., P. Jørgensen, T. Helgaker and O. Christiansen (2000) Divergence in Møller-Plesset theory: A simple explanation based on a two-state model. J. Chem. Phys. 112, 9736-9748.
    • (2000) J. Chem. Phys. , vol.112 , pp. 9736-9748
    • Olsen, J.1    Jørgensen, P.2    Helgaker, T.3    Christiansen, O.4
  • 20
    • 0032022674 scopus 로고    scopus 로고
    • Use of Møller-Plesset perturbation theory in molecular calculations: Spectroscopic constants of first row diatomic molecules
    • Dunning, T. H. and K. A. Peterson (1998) Use of Møller-Plesset perturbation theory in molecular calculations: Spectroscopic constants of first row diatomic molecules. J. Chem. Phys. 108, 4761-4771.
    • (1998) J. Chem. Phys. , vol.108 , pp. 4761-4771
    • Dunning, T.H.1    Peterson, K.A.2
  • 21
    • 6944251055 scopus 로고
    • Note on an approximation treatment for many-electron systems
    • Møller, C. and M. S. Plesset (1934) Note on an approximation treatment for many-electron systems. Phys. Rev. 46, 618-622.
    • (1934) Phys. Rev. , vol.46 , pp. 618-622
    • Møller, C.1    Plesset, M.S.2
  • 22
    • 33748338364 scopus 로고    scopus 로고
    • Coupled-cluster theory with emphasis on selected new developments
    • (In press, DOI: 10.1007/500214-005-0037-5)
    • Christiansen, O. (2006) Coupled-cluster theory with emphasis on selected new developments. Theor. Chem. Acc. (In press, DOI: 10.1007/500214-005-0037-5).
    • (2006) Theor. Chem. Acc.
    • Christiansen, O.1
  • 23
    • 0000111526 scopus 로고    scopus 로고
    • Coupled cluster theory
    • (Edited by P. v. R. Schleyer, N. L. Allinger, T. Clark, J. Gasteiger, P. A. Kollmann, H. F. Schaefer and P. R. Schreiner). Wiley, Chichester
    • Gauss, J. (1998) Coupled cluster theory. In Encyclopedia of Computational Chemistry (Edited by P. v. R. Schleyer, N. L. Allinger, T. Clark, J. Gasteiger, P. A. Kollmann, H. F. Schaefer and P. R. Schreiner). pp. 615-636. Wiley, Chichester.
    • (1998) Encyclopedia of Computational Chemistry , pp. 615-636
    • Gauss, J.1
  • 24
    • 0030125534 scopus 로고    scopus 로고
    • Dynamical and nondynamical correlation
    • Mok, D. K. W., R. Neumann and N. C. Handy (1996) Dynamical and nondynamical correlation. J. Phys. Chem. 100, 6225-6230.
    • (1996) J. Phys. Chem. , vol.100 , pp. 6225-6230
    • Mok, D.K.W.1    Neumann, R.2    Handy, N.C.3
  • 26
    • 30544453862 scopus 로고    scopus 로고
    • Automated derivation and parallel computer implementation of renormalized and active-space coupled-cluster methods
    • Piecuch, P., S. Hirata, K. Kowalski, P.-D. Fan and T. L. Windus (2006) Automated derivation and parallel computer implementation of renormalized and active-space coupled-cluster methods. Int. J. Quant. Chem. 106, 79-97.
    • (2006) Int. J. Quant. Chem. , vol.106 , pp. 79-97
    • Piecuch, P.1    Hirata, S.2    Kowalski, K.3    Fan, P.-D.4    Windus, T.L.5
  • 28
    • 0001093289 scopus 로고
    • The mechanism of the ene reaction of singlet oxygen with olefins
    • Harding, L. B. and W. A. Goddard (1980) The mechanism of the ene reaction of singlet oxygen with olefins. J. Am. Chem. Soc. 102, 439-449.
    • (1980) J. Am. Chem. Soc. , vol.102 , pp. 439-449
    • Harding, L.B.1    Goddard, W.A.2
  • 30
    • 0001102132 scopus 로고
    • Symmetry in density-functional theory
    • Görling, A. (1993) Symmetry in density-functional theory. Phys. Rev. A 47, 2783-2799.
    • (1993) Phys. Rev. A , vol.47 , pp. 2783-2799
    • Görling, A.1
  • 31
    • 0000820188 scopus 로고    scopus 로고
    • Application of spin-restricted open-shell Kohn-Sham method to atomic and molecular multiplet states
    • Filatov, M. and S. Shaik (1998) Application of spin-restricted open-shell Kohn-Sham method to atomic and molecular multiplet states. J. Chem. Phys. 110, 116-125.
    • (1998) J. Chem. Phys. , vol.110 , pp. 116-125
    • Filatov, M.1    Shaik, S.2
  • 32
    • 0037046714 scopus 로고    scopus 로고
    • Optimization of conical intersections with floating occupation semiempirical configuration interaction wave functions
    • Toniolo, A., M. Ben-Nun and T. J. Martinez (2002) Optimization of conical intersections with floating occupation semiempirical configuration interaction wave functions. J. Phys. Chem. A 106, 4679-4689.
    • (2002) J. Phys. Chem. A , vol.106 , pp. 4679-4689
    • Toniolo, A.1    Ben-Nun, M.2    Martinez, T.J.3
  • 33
    • 5644244488 scopus 로고    scopus 로고
    • Conical intersection dynamics in solution: The chromophore of green fluorescent protein
    • Toniolo, A., S. Olsen, L. Manohar and T. J. Martinez (2004) Conical intersection dynamics in solution: The chromophore of green fluorescent protein. Faraday Disc. 127, 149-163.
    • (2004) Faraday Disc. , vol.127 , pp. 149-163
    • Toniolo, A.1    Olsen, S.2    Manohar, L.3    Martinez, T.J.4
  • 34
    • 84987098062 scopus 로고
    • Intensities of spin-forbidden transitions in molecular oxygen
    • Minaev, B. F. (1980) Intensities of spin-forbidden transitions in molecular oxygen. Int. J. Quant. Chem. 17, 367-374.
    • (1980) Int. J. Quant. Chem. , vol.17 , pp. 367-374
    • Minaev, B.F.1
  • 35
    • 36549100225 scopus 로고
    • Linear and nonlinear response functions for an exact state and for an MCSCF state
    • Olsen, J. and P. Jørgensen (1985) Linear and nonlinear response functions for an exact state and for an MCSCF state. J. Chem. Phys. 82, 3235-3264.
    • (1985) J. Chem. Phys. , vol.82 , pp. 3235-3264
    • Olsen, J.1    Jørgensen, P.2
  • 36
    • 0000186252 scopus 로고
    • Time-dependent response theory with applications to self-consistent field and multiconfigurational self-consistent field wave functions
    • (Edited by D. R. Yarkony), World Scientific, Singapore
    • Olsen, J. and P. Jørgensen (1995) Time-dependent response theory with applications to self-consistent field and multiconfigurational self-consistent field wave functions. In Modern Electronic Structure Theory, Part II. Advanced Series in Physical Chemistry (Edited by D. R. Yarkony), pp. 857-990. World Scientific, Singapore.
    • (1995) Modern Electronic Structure Theory, Part II. Advanced Series in Physical Chemistry , pp. 857-990
    • Olsen, J.1    Jørgensen, P.2
  • 37
    • 0038924893 scopus 로고    scopus 로고
    • Response functions from a Fourier component variational perturbation theory applied to a time-averaged quasienergy
    • Christiansen, O., P. Jørgensen and C. Hättig (1998) Response functions from a Fourier component variational perturbation theory applied to a time-averaged quasienergy. Int. J. Quant. Chem. 68, 1-52.
    • (1998) Int. J. Quant. Chem. , vol.68 , pp. 1-52
    • Christiansen, O.1    Jørgensen, P.2    Hättig, C.3
  • 38
    • 1542595937 scopus 로고
    • Time-dependent density functional theory
    • Gross, E. K. U. and W. Kohn (1990) Time-dependent density functional theory. Adv. Quantum Chem. 21, 255-288.
    • (1990) Adv. Quantum Chem. , vol.21 , pp. 255-288
    • Gross, E.K.U.1    Kohn, W.2
  • 39
    • 0000344666 scopus 로고
    • Higher-order response theory based on the quasienergy derivatives: The derivation of the frequency-dependent polarizabilities and hyperpolarizabilities
    • Sasagane, K., F. Aiga and R. Itoh (1993) Higher-order response theory based on the quasienergy derivatives: The derivation of the frequency-dependent polarizabilities and hyperpolarizabilities. J. Chem. Phys. 99, 3738-3778.
    • (1993) J. Chem. Phys. , vol.99 , pp. 3738-3778
    • Sasagane, K.1    Aiga, F.2    Itoh, R.3
  • 40
    • 0036904361 scopus 로고    scopus 로고
    • Density functional theory of linear and nonlinear time-dependent molecular properties
    • Salek, P., O. Vahtras, T. Helgaker and H. Ågren (2002) Density functional theory of linear and nonlinear time-dependent molecular properties. J. Chem. Phys. 117, 9630-9645.
    • (2002) J. Chem. Phys. , vol.117 , pp. 9630-9645
    • Salek, P.1    Vahtras, O.2    Helgaker, T.3    Ågren, H.4
  • 41
    • 32044432133 scopus 로고    scopus 로고
    • Benchmarking two-photon absorption with CC3 quadratic response theory, and comparison with density functional response theory
    • Paterson, M. J., O. Christiansen, F. Pawlowski, P. Jørgensen, C. Hattig, T. Helgaker and P. Salek (2006) Benchmarking two-photon absorption with CC3 quadratic response theory, and comparison with density functional response theory. J. Chem. Phys. 124, 054322.
    • (2006) J. Chem. Phys. , vol.124 , pp. 054322
    • Paterson, M.J.1    Christiansen, O.2    Pawlowski, F.3    Jørgensen, P.4    Hattig, C.5    Helgaker, T.6    Salek, P.7
  • 43
    • 58149324359 scopus 로고
    • 2, and Ne in full configuration interaction and the hierarchy CCS, CC2, CCSD, and CC3 of coupled cluster models
    • 2, and Ne in full configuration interaction and the hierarchy CCS, CC2, CCSD, and CC3 of coupled cluster models. Chem. Phys. Lett. 244, 75-82.
    • (1995) Chem. Phys. Lett. , vol.244 , pp. 75-82
    • Koch, H.1    Christiansen, O.2    Jørgensen, P.3    Olsen, J.4
  • 44
    • 0942299406 scopus 로고    scopus 로고
    • Equation-of-motion spin-flip coupled-cluster model with single and double substitutions: Theory and application to cyclobutadiene
    • Levchenko, S. V. and A. I. Krylov (2004) Equation-of-motion spin-flip coupled-cluster model with single and double substitutions: Theory and application to cyclobutadiene. J. Chem. Phys. 120, 175-185.
    • (2004) J. Chem. Phys. , vol.120 , pp. 175-185
    • Levchenko, S.V.1    Krylov, A.I.2
  • 45
    • 23044498612 scopus 로고    scopus 로고
    • Coupled cluster methods including triple excitations for excited states of radicals
    • Smith, C. E., R. A. King and T. D. Crawford (2005) Coupled cluster methods including triple excitations for excited states of radicals. J. Chem. Phys. 122, 054110.
    • (2005) J. Chem. Phys. , vol.122 , pp. 054110
    • Smith, C.E.1    King, R.A.2    Crawford, T.D.3
  • 47
    • 0003140963 scopus 로고
    • Ab initio calculation of spin-orbit effects in molecules including electron correlation
    • (Edited by D. R. Yarkony), World Scientific, Singapore
    • Hess, B. A., C. M. Marian and S. D. Peyerimhoff (1995) Ab initio calculation of spin-orbit effects in molecules including electron correlation. In Modern Electronic Structure Theory, Part 1 (Edited by D. R. Yarkony), pp. 152-278. World Scientific, Singapore.
    • (1995) Modern Electronic Structure Theory , Issue.PART 1 , pp. 152-278
    • Hess, B.A.1    Marian, C.M.2    Peyerimhoff, S.D.3
  • 48
    • 0000604021 scopus 로고
    • Ab initio evaluation of the fine structure of the oxygen molecule
    • Langhoff, S. R. (1974) Ab initio evaluation of the fine structure of the oxygen molecule. J. Chem. Phys. 61, 1708-1716.
    • (1974) J. Chem. Phys. , vol.61 , pp. 1708-1716
    • Langhoff, S.R.1
  • 49
    • 36149002820 scopus 로고
    • Theory of the fine structure of the molecular oxygen ground state
    • Tinkham, M. and M. W. P. Strandberg (1955) Theory of the fine structure of the molecular oxygen ground state. Phys. Rev. 97, 937-951.
    • (1955) Phys. Rev. , vol.97 , pp. 937-951
    • Tinkham, M.1    Strandberg, M.W.P.2
  • 50
    • 36149020592 scopus 로고
    • Interaction of molecular oxygen with a magnetic field
    • Tinkham, M. and M. W. P. Strandberg (1955) Interaction of molecular oxygen with a magnetic field. Phys. Rev. 97, 951-966.
    • (1955) Phys. Rev. , vol.97 , pp. 951-966
    • Tinkham, M.1    Strandberg, M.W.P.2
  • 53
    • 0002664139 scopus 로고
    • Application of the collision complex model to the photophysical processes of singlet oxygen in liquids
    • Lin, S. H., J. Lewis and T. A. Moore (1991) Application of the collision complex model to the photophysical processes of singlet oxygen in liquids. J. Photochem. Photobiol. A: Chem. 56, 25-34.
    • (1991) J. Photochem. Photobiol. A: Chem. , vol.56 , pp. 25-34
    • Lin, S.H.1    Lewis, J.2    Moore, T.A.3
  • 54
    • 0001170071 scopus 로고
    • Fourier-transform luminescence spectroscopy of solvated singlet oxygen
    • Macpherson, A. N., T. G. Truscott and P. H. Turner (1994) Fourier-transform luminescence spectroscopy of solvated singlet oxygen. J. Chem. Soc. Faraday Trans. 90, 1065-1072.
    • (1994) J. Chem. Soc. Faraday Trans. , vol.90 , pp. 1065-1072
    • Macpherson, A.N.1    Truscott, T.G.2    Turner, P.H.3
  • 55
    • 33751154836 scopus 로고
    • - transition in molecular oxygen: A Fourier transform near-infrared luminescence study
    • - transition in molecular oxygen: A Fourier transform near-infrared luminescence study. J. Phys. Chem. 99, 17586-17592.
    • (1995) J. Phys. Chem. , vol.99 , pp. 17586-17592
    • Wessels, J.M.1    Rodgers, M.A.J.2
  • 57
    • 1842832022 scopus 로고    scopus 로고
    • Ab initio study of the ground state properties of molecular oxygen
    • Minaev, B. F. (2004) Ab initio study of the ground state properties of molecular oxygen. Spectrochim. Acta, A 60, 1027-1041.
    • (2004) Spectrochim. Acta, A , vol.60 , pp. 1027-1041
    • Minaev, B.F.1
  • 58
    • 33750817741 scopus 로고
    • Radiative lifetimes on singlet oxygen molecule: A perturbation-variation calculation
    • Carr, C. E., Y. K. Pan and T. Y. Chang (1976) Radiative lifetimes on singlet oxygen molecule: A perturbation-variation calculation. Chem. Phys. 18, 251-256.
    • (1976) Chem. Phys. , vol.18 , pp. 251-256
    • Carr, C.E.1    Pan, Y.K.2    Chang, T.Y.3
  • 59
    • 33750818793 scopus 로고
    • Radiative lifetimes of the singlet oxygen molecule
    • Zhu, J. K., J. Li and Y. K. Pan (1981) Radiative lifetimes of the singlet oxygen molecule. Chem. Phys. Lett. 78, 129-130.
    • (1981) Chem. Phys. Lett. , vol.78 , pp. 129-130
    • Zhu, J.K.1    Li, J.2    Pan, Y.K.3
  • 61
    • 5244381538 scopus 로고
    • High-resolution spectroscopy of the oxygen A band
    • Ritter, K. J. and T. D. Wilkerson (1987) High-resolution spectroscopy of the oxygen A band. J. Mol. Spectrosc. 121, 1-19.
    • (1987) J. Mol. Spectrosc. , vol.121 , pp. 1-19
    • Ritter, K.J.1    Wilkerson, T.D.2
  • 64
    • 0034650086 scopus 로고    scopus 로고
    • Oxygen absorption below and near the Herzberg I continuum. Ab initio calculation of the transition probability from metastable states
    • Minaev, B. F. (2000) Oxygen absorption below and near the Herzberg I continuum. Ab initio calculation of the transition probability from metastable states. Chem. Phys. 252, 25-46.
    • (2000) Chem. Phys. , vol.252 , pp. 25-46
    • Minaev, B.F.1
  • 65
    • 33947474491 scopus 로고
    • Molecular complexes and their spectra. XII. Ultraviolet absorption spectra caused by the interaction of oxygen with organic molecules
    • Tsubomura, H. and R. S. Mulliken (1960) Molecular complexes and their spectra. XII. Ultraviolet absorption spectra caused by the interaction of oxygen with organic molecules. J. Am. Chem. Soc. 82, 5966-5974.
    • (1960) J. Am. Chem. Soc. , vol.82 , pp. 5966-5974
    • Tsubomura, H.1    Mulliken, R.S.2
  • 66
    • 0000218460 scopus 로고    scopus 로고
    • - transition in molecular oxygen: Interpretation of solvent effects on spectral shifts
    • - transition in molecular oxygen: Interpretation of solvent effects on spectral shifts. J. Phys. Chem. A 103, 3418-3422.
    • (1999) J. Phys. Chem. A , vol.103 , pp. 3418-3422
    • Poulsen, T.D.1    Ogilby, P.R.2    Mikkelsen, K.V.3
  • 68
    • 36849099988 scopus 로고
    • Why is condensed oxygen blue?
    • Tsai, S. C. and G. W. Robinson (1969) Why is condensed oxygen blue? J. Chem. Phys. 51, 3559-3568.
    • (1969) J. Chem. Phys. , vol.51 , pp. 3559-3568
    • Tsai, S.C.1    Robinson, G.W.2
  • 69
    • 36849104490 scopus 로고
    • Intensity enhancement of forbidden electronic transitions by weak intermolecular interactions
    • Robinson, G. W. (1967) Intensity enhancement of forbidden electronic transitions by weak intermolecular interactions. J. Chem. Phys. 46, 572-585.
    • (1967) J. Chem. Phys. , vol.46 , pp. 572-585
    • Robinson, G.W.1
  • 70
    • 0342599942 scopus 로고
    • Simultaneous and induced electronic transitions in oxygen
    • Krishna, V. G. (1969) Simultaneous and induced electronic transitions in oxygen. J. Chem. Phys. 50, 792-799.
    • (1969) J. Chem. Phys. , vol.50 , pp. 792-799
    • Krishna, V.G.1
  • 71
    • 84961980477 scopus 로고    scopus 로고
    • Quantum mechanical continuum solvation models
    • Tomasi, J., B. Mennucci and R. Cammi (2005) Quantum mechanical continuum solvation models. Chem. Rev. 105, 2999-3093.
    • (2005) Chem. Rev. , vol.105 , pp. 2999-3093
    • Tomasi, J.1    Mennucci, B.2    Cammi, R.3
  • 72
    • 0000435423 scopus 로고    scopus 로고
    • Quadratic response of molecules in a nonequilibrium and equilibrium solvation model: Generalizations to include both singlet and triplet perturbations
    • Poulsen, T. D., P. R. Ogilby and K. V. Mikkelsen (1999) Quadratic response of molecules in a nonequilibrium and equilibrium solvation model: Generalizations to include both singlet and triplet perturbations. J. Chem. Phys. 111, 2678-2685.
    • (1999) J. Chem. Phys. , vol.111 , pp. 2678-2685
    • Poulsen, T.D.1    Ogilby, P.R.2    Mikkelsen, K.V.3
  • 75
    • 0035828026 scopus 로고    scopus 로고
    • The combined multiconfigurational self-consistent-field/molecular mechanics wave function approach
    • Poulsen, T. D., J. Kongsted, A. Osted, P. R. Ogilby and K. V. Mikkelsen (2001) The combined multiconfigurational self-consistent-field/molecular mechanics wave function approach. J. Chem. Phys. 115, 2393-2400.
    • (2001) J. Chem. Phys. , vol.115 , pp. 2393-2400
    • Poulsen, T.D.1    Kongsted, J.2    Osted, A.3    Ogilby, P.R.4    Mikkelsen, K.V.5
  • 76
    • 0035504573 scopus 로고    scopus 로고
    • A quantum mechanical method for calculating nonlinear optical properties of condensed phase molecules coupled to a molecular mechanics field: A quadratic multiconfigurational self-consistent-field/molecular mechanics method
    • Poulsen, T. D., P. R. Ogilby and K. V. Mikkelsen (2001) A quantum mechanical method for calculating nonlinear optical properties of condensed phase molecules coupled to a molecular mechanics field: A quadratic multiconfigurational self-consistent-field/molecular mechanics method. J. Chem. Phys. 115, 7843-7851.
    • (2001) J. Chem. Phys. , vol.115 , pp. 7843-7851
    • Poulsen, T.D.1    Ogilby, P.R.2    Mikkelsen, K.V.3
  • 77
    • 0036492218 scopus 로고    scopus 로고
    • Linear response properties for solvated molecules described by a combined multiconfigurational self-consistent field/molecular mechanics model
    • Poulsen, T. D., P. R. Ogilby and K. V. Mikkelsen (2002) Linear response properties for solvated molecules described by a combined multiconfigurational self-consistent field/molecular mechanics model. J. Chem. Phys. 116, 3730-3738.
    • (2002) J. Chem. Phys. , vol.116 , pp. 3730-3738
    • Poulsen, T.D.1    Ogilby, P.R.2    Mikkelsen, K.V.3
  • 78
    • 9744232159 scopus 로고    scopus 로고
    • Solvent effects on the n to π* electronic transition in formaldehyde: A combined coupled-cluster/molecular dynamics study
    • Kongsted, J., A. Osted, K. V. Mikkelsen, P.-O. Åstrand and O. Christiansen (2004) Solvent effects on the n to π* electronic transition in formaldehyde: A combined coupled-cluster/molecular dynamics study. J. Chem. Phys. 121, 8435-8445.
    • (2004) J. Chem. Phys. , vol.121 , pp. 8435-8445
    • Kongsted, J.1    Osted, A.2    Mikkelsen, K.V.3    Åstrand, P.-O.4    Christiansen, O.5
  • 79
    • 37049051916 scopus 로고
    • Magnetic perturbation of singlet-triplet transitions. Part V. Mechanism
    • Evans, D. F. (1961) Magnetic perturbation of singlet-triplet transitions. Part V. Mechanism. J. Chem. Soc. 1987-1993.
    • (1961) J. Chem. Soc. , pp. 1987-1993
    • Evans, D.F.1
  • 80
    • 0003043644 scopus 로고
    • The effect of paramagnetic molecules on the intensity of spin-forbidden absorption bands of aromatic molecules
    • Murrell, J. N. (1960) The effect of paramagnetic molecules on the intensity of spin-forbidden absorption bands of aromatic molecules. Mol. Phys. 3, 319-329.
    • (1960) Mol. Phys. , vol.3 , pp. 319-329
    • Murrell, J.N.1
  • 81
    • 0038322621 scopus 로고    scopus 로고
    • Physical mechanisms of generation and deactivation of singlet oxygen
    • Schweitzer, C. and R. Schmidt (2003) Physical mechanisms of generation and deactivation of singlet oxygen. Chem. Rev. 103, 1685-1757.
    • (2003) Chem. Rev. , vol.103 , pp. 1685-1757
    • Schweitzer, C.1    Schmidt, R.2
  • 82
    • 0000586380 scopus 로고
    • Solvent effects on the oxygen-organic molecule charge-transfer absorption
    • Kuriyama, Y., P. R. Ogilby and K. V. Mikkelsen (1994) Solvent effects on the oxygen-organic molecule charge-transfer absorption. J. Phys. Chem. 98, 11918-11923.
    • (1994) J. Phys. Chem. , vol.98 , pp. 11918-11923
    • Kuriyama, Y.1    Ogilby, P.R.2    Mikkelsen, K.V.3
  • 83
    • 36849111805 scopus 로고
    • Role of singlet excited states of molecular oxygen in the quenching of organic triplet states
    • Kawaoka, K., A. U. Khan and D. R. Kearns (1967) Role of singlet excited states of molecular oxygen in the quenching of organic triplet states. J. Chem. Phys. 46, 1842-1853.
    • (1967) J. Chem. Phys. , vol.46 , pp. 1842-1853
    • Kawaoka, K.1    Khan, A.U.2    Kearns, D.R.3
  • 84
    • 0008457944 scopus 로고
    • Erratum: Role of singlet excited states of molecular oxygen in the quenching of organic triplet states
    • Kawaoka, K., A. U. Khan and D. R. Kearns (1967) Erratum: Role of singlet excited states of molecular oxygen in the quenching of organic triplet states. J. Chem. Phys. 47, 1883-1884.
    • (1967) J. Chem. Phys. , vol.47 , pp. 1883-1884
    • Kawaoka, K.1    Khan, A.U.2    Kearns, D.R.3
  • 85
    • 36849098961 scopus 로고
    • Energetics of the interaction of molecular oxygen with organic molecules
    • Khan, A. U. and D. R. Kearns (1968) Energetics of the interaction of molecular oxygen with organic molecules. J. Chem. Phys. 48, 3272-3275.
    • (1968) J. Chem. Phys. , vol.48 , pp. 3272-3275
    • Khan, A.U.1    Kearns, D.R.2
  • 87
    • 0000151772 scopus 로고
    • Van der Waals and charge-transfer complexes of molecular oxygen and water
    • Byers Brown, W., M. A. Vincent, K. Trollope and I. H. Hillier (1992) Van der Waals and charge-transfer complexes of molecular oxygen and water. Chem. Phys. Lett. 192, 213-216.
    • (1992) Chem. Phys. Lett. , vol.192 , pp. 213-216
    • Byers Brown, W.1    Vincent, M.A.2    Trollope, K.3    Hillier, I.H.4
  • 88
    • 0000372770 scopus 로고
    • Complexes of oxygen with benzene and hexafluorobenzene
    • Grover, J. R., G. Hagenow and E. A. Walters (1992) Complexes of oxygen with benzene and hexafluorobenzene. J. Chem. Phys. 97, 628-642.
    • (1992) J. Chem. Phys. , vol.97 , pp. 628-642
    • Grover, J.R.1    Hagenow, G.2    Walters, E.A.3
  • 89
    • 0004709372 scopus 로고
    • 2 interaction potential from ab initio calculations
    • 2 interaction potential from ab initio calculations. Chem. Phys. Lett. 205, 331-336.
    • (1993) Chem. Phys. Lett. , vol.205 , pp. 331-336
    • Granucci, G.1    Persico, M.2
  • 91
    • 0000121022 scopus 로고
    • 4 exciplex: Collision-induced probabilities of spin-forbidden radiative and non-radiative transitions
    • 4 exciplex: Collision-induced probabilities of spin-forbidden radiative and non-radiative transitions. J. Chem. Soc. Faraday Trans. 90, 1479-1486.
    • (1994) J. Chem. Soc. Faraday Trans. , vol.90 , pp. 1479-1486
    • Minaev, B.F.1    Kukueva, V.V.2    Ågren, H.3
  • 92
    • 0040600502 scopus 로고    scopus 로고
    • Collision-induced electronic transitions in complexes between benzene and molecular oxygen
    • Minaev, B. F., K. V. Mikkelsen and H. Ågren (1997) Collision-induced electronic transitions in complexes between benzene and molecular oxygen. Chem. Phys. 220, 79-94.
    • (1997) Chem. Phys. , vol.220 , pp. 79-94
    • Minaev, B.F.1    Mikkelsen, K.V.2    Ågren, H.3
  • 94
    • 0000728269 scopus 로고
    • The ground state benzene-oxygen complex
    • Gooding, E. A., K. R. Serak and P. R. Ogilby (1991) The ground state benzene-oxygen complex. J. Phys. Chem. 95, 7868-7871.
    • (1991) J. Phys. Chem. , vol.95 , pp. 7868-7871
    • Gooding, E.A.1    Serak, K.R.2    Ogilby, P.R.3
  • 95
    • 0001486038 scopus 로고    scopus 로고
    • Thermochemistry of the gas phase molecular complex of benzene with oxygen
    • Casero, J. J. and J. A. Joens (1997) Thermochemistry of the gas phase molecular complex of benzene with oxygen. J. Phys. Chem. A 101, 2607-2609.
    • (1997) J. Phys. Chem. A , vol.101 , pp. 2607-2609
    • Casero, J.J.1    Joens, J.A.2
  • 96
    • 0043225194 scopus 로고    scopus 로고
    • Thermochemistry of gas-phase molecular complexes of fluorobenzene and toluene with oxygen
    • Casero, J. J. and J. A. Joens (1999) Thermochemistry of gas-phase molecular complexes of fluorobenzene and toluene with oxygen. J. Phys. Chem. A 103, 7136-7138.
    • (1999) J. Phys. Chem. A , vol.103 , pp. 7136-7138
    • Casero, J.J.1    Joens, J.A.2
  • 97
    • 0005447103 scopus 로고
    • Theory of electronic energy relaxation in the solid phase
    • Robinson, G. W. and R. P. Frosch (1962) Theory of electronic energy relaxation in the solid phase. J. Chem. Phys. 37, 1962-1973.
    • (1962) J. Chem. Phys. , vol.37 , pp. 1962-1973
    • Robinson, G.W.1    Frosch, R.P.2
  • 98
    • 36849124302 scopus 로고
    • Electronic excitation transfer and relaxation
    • Robinson, G. W. and R. P. Frosch (1963) Electronic excitation transfer and relaxation. J. Chem. Phys. 38, 1187-1203.
    • (1963) J. Chem. Phys. , vol.38 , pp. 1187-1203
    • Robinson, G.W.1    Frosch, R.P.2
  • 100
    • 0345818086 scopus 로고
    • Radiationless decay of singlet molecular oxygen in solution. An experimental and theoretical study of electronic-to-vibrational energy transfer
    • Merkel, P. B. and D. R. Kearns (1972) Radiationless decay of singlet molecular oxygen in solution. An experimental and theoretical study of electronic-to-vibrational energy transfer. J. Am. Chem. Soc. 94, 7244-7253.
    • (1972) J. Am. Chem. Soc. , vol.94 , pp. 7244-7253
    • Merkel, P.B.1    Kearns, D.R.2
  • 102
    • 33750817192 scopus 로고
    • Theoretical and experimental study of the quenching of singlet oxygen by solvent
    • Lin, Y. Y., Z. T. Chu and S. H. Lin (1988) Theoretical and experimental study of the quenching of singlet oxygen by solvent. J. Photochem. Photobiol. A: Chem. 44, 229-242.
    • (1988) J. Photochem. Photobiol. A: Chem. , vol.44 , pp. 229-242
    • Lin, Y.Y.1    Chu, Z.T.2    Lin, S.H.3
  • 103
    • 0001380974 scopus 로고
    • Solvent shift of singlet oxygen emission wavelength
    • Bromberg, A. and C. S. Foote (1989) Solvent shift of singlet oxygen emission wavelength. J. Phys. Chem 93, 3968-3969.
    • (1989) J. Phys. Chem , vol.93 , pp. 3968-3969
    • Bromberg, A.1    Foote, C.S.2
  • 105
    • 0032539193 scopus 로고    scopus 로고
    • Time-resolved absorption spectrum of singlet oxygen in solution
    • Weldon, D. and P. R. Ogilby (1998) Time-resolved absorption spectrum of singlet oxygen in solution. J. Am. Chem. Soc. 120, 12978-12979.
    • (1998) J. Am. Chem. Soc. , vol.120 , pp. 12978-12979
    • Weldon, D.1    Ogilby, P.R.2
  • 107
    • 0037153265 scopus 로고    scopus 로고
    • 2O: Enabling the test of a model for the effect of solvent on oxygen's radiative transitions
    • 2O: Enabling the test of a model for the effect of solvent on oxygen's radiative transitions. J. Phys. Chem. A. 106, 11064-11069.
    • (2002) J. Phys. Chem. A , vol.106 , pp. 11064-11069
    • Andersen, L.K.1    Ogilby, P.R.2
  • 108
    • 0032817121 scopus 로고    scopus 로고
    • Solvent effects on the radiative transitions of singlet oxygen
    • Ogilby, P. R. (1999) Solvent effects on the radiative transitions of singlet oxygen. Acc. Chem. Res. 32, 512-519.
    • (1999) Acc. Chem. Res. , vol.32 , pp. 512-519
    • Ogilby, P.R.1
  • 110
    • 33846187357 scopus 로고
    • The influence of intermolecular interaction on the forbidden near-IR transitions in molecular oxygen
    • Minaev, B. F., S. Lunell and G. I. Kobzev (1993) The influence of intermolecular interaction on the forbidden near-IR transitions in molecular oxygen. J. Mol. Struct. (Theochem.) 284, 1-9.
    • (1993) J. Mol. Struct. (Theochem.) , vol.284 , pp. 1-9
    • Minaev, B.F.1    Lunell, S.2    Kobzev, G.I.3
  • 111
    • 0242271888 scopus 로고    scopus 로고
    • Response calculations of electronic and vibrational transitions in molecular oxygen induced by interaction with noble gases
    • Minaev, B. F. and G. I. Kobzev (2003) Response calculations of electronic and vibrational transitions in molecular oxygen induced by interaction with noble gases. Spectrochim. Acta A. 59, 3387-3410.
    • (2003) Spectrochim. Acta A , vol.59 , pp. 3387-3410
    • Minaev, B.F.1    Kobzev, G.I.2
  • 112
  • 119
    • 84889533712 scopus 로고
    • Rate constants for the decay and reactions of the lowest electronically excited singlet state of molecular oxygen in solution. An expanded and revised compilation
    • Wilkinson, F., W. P. Helman and A. B. Ross (1995) Rate constants for the decay and reactions of the lowest electronically excited singlet state of molecular oxygen in solution. An expanded and revised compilation. J. Phys. Chem. Ref. Data 24, 663-1021.
    • (1995) J. Phys. Chem. Ref. Data , vol.24 , pp. 663-1021
    • Wilkinson, F.1    Helman, W.P.2    Ross, A.B.3
  • 124
    • 0042874555 scopus 로고
    • g oxygen molecules in sensitized photooxygenations
    • g oxygen molecules in sensitized photooxygenations. Adv. Chem. Sci: 77, 143-165.
    • (1968) Adv. Chem. Sci , vol.77 , pp. 143-165
    • Khan, A.U.1    Kearns, D.R.2
  • 125
    • 0041647492 scopus 로고
    • Intracavity dye laser photoactivation of chemical reactions
    • Reddy, K. V. and M. J. Berry (1978) Intracavity dye laser photoactivation of chemical reactions. J. Opt. Soc. Am. 68, 694.
    • (1978) J. Opt. Soc. Am. , vol.68 , pp. 694
    • Reddy, K.V.1    Berry, M.J.2
  • 126
    • 0000913128 scopus 로고
    • Photosensitized oxygenations and the role of singlet oxygen
    • Foote, C. S. (1968) Photosensitized oxygenations and the role of singlet oxygen. Acc. Chem. Res. 1, 104-110.
    • (1968) Acc. Chem. Res. , vol.1 , pp. 104-110
    • Foote, C.S.1
  • 127
    • 33748241758 scopus 로고    scopus 로고
    • The Schenck ene reaction: Diastereoselective oxyfunctionalization with singlet oxygen in synthetic applications
    • Prein, M. and W. Adam (1996) The Schenck ene reaction: Diastereoselective oxyfunctionalization with singlet oxygen in synthetic applications. Angew. Chem. Int. Ed. 35, 477-494.
    • (1996) Angew. Chem. Int. Ed. , vol.35 , pp. 477-494
    • Prein, M.1    Adam, W.2
  • 128
    • 0034680706 scopus 로고    scopus 로고
    • New mechanistic and synthetic aspects of singlet oxygen chemistry
    • Clennan, E. L. (2000) New mechanistic and synthetic aspects of singlet oxygen chemistry. Tetrahedron 56, 9151-9179.
    • (2000) Tetrahedron , vol.56 , pp. 9151-9179
    • Clennan, E.L.1
  • 129
    • 20444464941 scopus 로고    scopus 로고
    • Advances in singlet oxygen chemistry
    • Clennan, E. L. and A. Pace (2005) Advances in singlet oxygen chemistry. Tetrahedron 61, 6665-6691.
    • (2005) Tetrahedron , vol.61 , pp. 6665-6691
    • Clennan, E.L.1    Pace, A.2
  • 130
    • 0003404419 scopus 로고
    • Selection rules for singlet-oxygen reactions. Concerted addition reactions
    • Kearns, D. R. (1969) Selection rules for singlet-oxygen reactions. Concerted addition reactions. J. Am. Chem. Soc. 91, 6554-6563.
    • (1969) J. Am. Chem. Soc. , vol.91 , pp. 6554-6563
    • Kearns, D.R.1
  • 131
    • 0000934374 scopus 로고
    • On the mechanism of photooxygenation reactions. Computational evidence against the diradical mechanism of singlet oxygen ene reactions
    • Yamaguchi, K., S. Yabushita, T. Fueno and K. N. Houk (1981) On the mechanism of photooxygenation reactions. Computational evidence against the diradical mechanism of singlet oxygen ene reactions. J. Am. Chem. Soc. 103, 5043-5046.
    • (1981) J. Am. Chem. Soc. , vol.103 , pp. 5043-5046
    • Yamaguchi, K.1    Yabushita, S.2    Fueno, T.3    Houk, K.N.4
  • 133
    • 0001215174 scopus 로고
    • Hetero-Diels-Alder reaction transition structures: Reactivity, stereoselectivity, catalysis, solvent effects, and the exo-lone-pair effect
    • McCarrick, M. A., Y.-D. Wu and K. N. Houk (1993) Hetero-Diels-Alder reaction transition structures: Reactivity, stereoselectivity, catalysis, solvent effects, and the exo-lone-pair effect. J. Org. Chem. 58, 3330-3343.
    • (1993) J. Org. Chem. , vol.58 , pp. 3330-3343
    • McCarrick, M.A.1    Wu, Y.-D.2    Houk, K.N.3
  • 134
    • 0034734369 scopus 로고    scopus 로고
    • CAS MCSCF/CAS MCQDPT2 Study of the mechanism of singlet oxygen addition to 1,3-butadiene and benzene
    • Bobrowski, M., A. Liwo, S. Oldziej, D. Jeziorek and T. Ossowski (2000) CAS MCSCF/CAS MCQDPT2 Study of the mechanism of singlet oxygen addition to 1,3-butadiene and benzene. J. Am. Chem. Soc. 122, 8112-8119.
    • (2000) J. Am. Chem. Soc. , vol.122 , pp. 8112-8119
    • Bobrowski, M.1    Liwo, A.2    Oldziej, S.3    Jeziorek, D.4    Ossowski, T.5
  • 135
    • 0034814448 scopus 로고    scopus 로고
    • Reactions of 1,3-cyclohexadiene with singlet oxygen. A theoretical study
    • Sevin, F. and M. L. McKee (2001) Reactions of 1,3-cyclohexadiene with singlet oxygen. A theoretical study. J. Am. Chem. Soc. 123, 4591-4600.
    • (2001) J. Am. Chem. Soc. , vol.123 , pp. 4591-4600
    • Sevin, F.1    McKee, M.L.2
  • 138
    • 0033996913 scopus 로고    scopus 로고
    • g dioxygen with ethene, methyl vinyl ether, and butadiene: A density functional and multireference perturbation theory study
    • g dioxygen with ethene, methyl vinyl ether, and butadiene: A density functional and multireference perturbation theory study. J. Am. Chem. Soc. 122, 1414-1423.
    • (2000) J. Am. Chem. Soc. , vol.122 , pp. 1414-1423
    • Maranzana, A.1    Ghigo, G.2    Tonachini, G.3
  • 139
    • 0036263485 scopus 로고    scopus 로고
    • Diels-Alder and ene reactions of singlet oxygen, nitroso compounds and triazolinediones: Transition states and mechanisms from contemporary theory
    • Leach, A. G. and K. N. Houk (2002) Diels-Alder and ene reactions of singlet oxygen, nitroso compounds and triazolinediones: Transition states and mechanisms from contemporary theory. Chem. Commun. 1243-1255.
    • (2002) Chem. Commun. , pp. 1243-1255
    • Leach, A.G.1    Houk, K.N.2
  • 141
    • 5644273803 scopus 로고    scopus 로고
    • Variational transition state theory as a tool to determine kinetic selectivity in reactions involving a valley-ridge inflection point
    • Gonzalez-Lafont, A., M. Moreno and J. M. Lluch (2004) Variational transition state theory as a tool to determine kinetic selectivity in reactions involving a valley-ridge inflection point. J. Am. Chem. Soc. 126, 13089-13094.
    • (2004) J. Am. Chem. Soc. , vol.126 , pp. 13089-13094
    • Gonzalez-Lafont, A.1    Moreno, M.2    Lluch, J.M.3
  • 142
    • 0002393586 scopus 로고
    • Theoretical aspects of the reaction of organic sulfur and phosphorous compounds with singlet oxygen
    • (Edited by A. L. Baumstark), JAI Press, Greenwich, CT
    • Jensen, F. (1995) Theoretical aspects of the reaction of organic sulfur and phosphorous compounds with singlet oxygen. In Advances in Oxygenated Processes, Vol. 4 (Edited by A. L. Baumstark), pp. 1-48. JAI Press, Greenwich, CT.
    • (1995) Advances in Oxygenated Processes , vol.4 , pp. 1-48
    • Jensen, F.1
  • 143
    • 33947292873 scopus 로고
    • Chemistry of singlet oxygen. XIV. Reactive intermediate in sulfide photooxidation
    • Foote, C. S. and J. W. Peters (1971) Chemistry of singlet oxygen. XIV. Reactive intermediate in sulfide photooxidation. J. Am. Chem. Soc. 93, 3795-3796.
    • (1971) J. Am. Chem. Soc. , vol.93 , pp. 3795-3796
    • Foote, C.S.1    Peters, J.W.2
  • 144
    • 0032513702 scopus 로고    scopus 로고
    • Reaction of organic sulfides with singlet oxygen. A revised mechanism
    • Jensen, F., A. Greer and E. L. Clennan (1998) Reaction of organic sulfides with singlet oxygen. A revised mechanism. J. Am. Chem. Soc. 120, 4439-4449.
    • (1998) J. Am. Chem. Soc. , vol.120 , pp. 4439-4449
    • Jensen, F.1    Greer, A.2    Clennan, E.L.3
  • 145
    • 10844232947 scopus 로고    scopus 로고
    • Calculation of excited-state properties using general coupled-cluster and configuration-interaction models
    • Kallay, M. and J. Gauss (2004) Calculation of excited-state properties using general coupled-cluster and configuration-interaction models. J. Chem. Phys. 121, 9257-9269.
    • (2004) J. Chem. Phys. , vol.121 , pp. 9257-9269
    • Kallay, M.1    Gauss, J.2
  • 147
    • 0037473489 scopus 로고    scopus 로고
    • Implementation of a general multireference configuration interaction procedure with analytic gradients in a semiempirical context using the graphical unitray group approach
    • Koslowski, A., M. E. Beck and W. Thiel (2003) Implementation of a general multireference configuration interaction procedure with analytic gradients in a semiempirical context using the graphical unitray group approach. J. Comp. Chem. 24, 714-726.
    • (2003) J. Comp. Chem. , vol.24 , pp. 714-726
    • Koslowski, A.1    Beck, M.E.2    Thiel, W.3
  • 148
    • 1442306230 scopus 로고    scopus 로고
    • A second quantization formulation of multi-mode dynamics
    • Christiansen, O. (2004) A second quantization formulation of multi-mode dynamics. J. Chem. Phys. 120, 2140-2148.
    • (2004) J. Chem. Phys. , vol.120 , pp. 2140-2148
    • Christiansen, O.1
  • 149
    • 1442331124 scopus 로고    scopus 로고
    • Vibrational coupled-cluster theory
    • Christiansen, O. (2004) Vibrational coupled-cluster theory. J. Chem. Phys. 120, 2149-2159.
    • (2004) J. Chem. Phys. , vol.120 , pp. 2149-2159
    • Christiansen, O.1
  • 150
    • 21444433510 scopus 로고    scopus 로고
    • Response theory for vibrational wavefunctions
    • Christiansen, O. (2005) Response theory for vibrational wavefunctions. J. Chem. Phys. 122, 194105.
    • (2005) J. Chem. Phys. , vol.122 , pp. 194105
    • Christiansen, O.1
  • 151
    • 24144442662 scopus 로고    scopus 로고
    • Synthesis and characterization of water-soluble phenylene-vinylene-based singlet oxygen sensitizers for two-photon excitation
    • Nielsen, C. B., M. Johnsen, J. Arnbjerg, M. Pittelkow, S. P. McIlroy, P. R. Ogilby and M. Jørgensen (2005) Synthesis and characterization of water-soluble phenylene-vinylene-based singlet oxygen sensitizers for two-photon excitation. J. Org. Chem. 70, 7065-7079.
    • (2005) J. Org. Chem. , vol.70 , pp. 7065-7079
    • Nielsen, C.B.1    Johnsen, M.2    Arnbjerg, J.3    Pittelkow, M.4    McIlroy, S.P.5    Ogilby, P.R.6    Jørgensen, M.7
  • 153
    • 0035961103 scopus 로고    scopus 로고
    • Two-photon singlet oxygen sensitizers: Quantifying, modeling, and optimizing the two-photon absorption cross section
    • Poulsen, T. D., P. K. Frederiksen, M. Jørgensen, K. V. Mikkelsen and P. R. Ogilby (2001) Two-photon singlet oxygen sensitizers: Quantifying, modeling, and optimizing the two-photon absorption cross section. J. Phys. Chem. A 105, 11488-11495.
    • (2001) J. Phys. Chem. A , vol.105 , pp. 11488-11495
    • Poulsen, T.D.1    Frederiksen, P.K.2    Jørgensen, M.3    Mikkelsen, K.V.4    Ogilby, P.R.5
  • 154
    • 0035857466 scopus 로고    scopus 로고
    • Two-photon photosensitized production of singlet oxygen
    • Frederiksen, P. K., M. Jørgensen and P. R. Ogilby (2001) Two-photon photosensitized production of singlet oxygen. J. Am. Chem. Soc. 123, 1215-1221.
    • (2001) J. Am. Chem. Soc. , vol.123 , pp. 1215-1221
    • Frederiksen, P.K.1    Jørgensen, M.2    Ogilby, P.R.3
  • 155
    • 18744397861 scopus 로고    scopus 로고
    • Photosensitization of singlet oxygen via two-photon-excited fluorescence resonance energy transfer in a water-soluble dendrimer
    • Oar, M. A., J. M. Serin, W. R. Dichtel, J. M. J. Fréchet, T. Y. Ohulchanskyy and P. N. Prasad (2005) Photosensitization of singlet oxygen via two-photon-excited fluorescence resonance energy transfer in a water-soluble dendrimer. Chem. Mater. 17, 2267-2275.
    • (2005) Chem. Mater. , vol.17 , pp. 2267-2275
    • Oar, M.A.1    Serin, J.M.2    Dichtel, W.R.3    Fréchet, J.M.J.4    Ohulchanskyy, T.Y.5    Prasad, P.N.6
  • 156
    • 18144397249 scopus 로고    scopus 로고
    • Extremely strong near-IR two-photon absorption in conjugated porphyrin dimers: Quantitative description with three-essential-states model
    • Drobizhev, M., Y. Stepanenko, Y. Dzenis, A. Karotki, A. Rebane, P. N. Taylor and H. L. Anderson (2005) Extremely strong near-IR two-photon absorption in conjugated porphyrin dimers: Quantitative description with three-essential-states model. J. Phys. Chem. B 109, 7223-7236.
    • (2005) J. Phys. Chem. B , vol.109 , pp. 7223-7236
    • Drobizhev, M.1    Stepanenko, Y.2    Dzenis, Y.3    Karotki, A.4    Rebane, A.5    Taylor, P.N.6    Anderson, H.L.7
  • 157
    • 0035827209 scopus 로고    scopus 로고
    • Effects of pi centers and symmetry on two-photon absorption cross sections of organic chromophores
    • Wang, C.-K., P. Macak, Y. Luo and H. Ågren (2001) Effects of pi centers and symmetry on two-photon absorption cross sections of organic chromophores. J. Chem. Phys. 114, 9813-9820.
    • (2001) J. Chem. Phys. , vol.114 , pp. 9813-9820
    • Wang, C.-K.1    Macak, P.2    Luo, Y.3    Ågren, H.4
  • 158
    • 0003148455 scopus 로고    scopus 로고
    • Mechanisms for enhancement of two-photon absorption in donor-acceptor conjugated chromophores
    • Kogej, T., D. Beljonne, F. Meyers, J. W. Perry, S. R. Marder and J. L. Brédas (1998) Mechanisms for enhancement of two-photon absorption in donor-acceptor conjugated chromophores. Chem. Phys. Lett. 298, 1-6.
    • (1998) Chem. Phys. Lett. , vol.298 , pp. 1-6
    • Kogej, T.1    Beljonne, D.2    Meyers, F.3    Perry, J.W.4    Marder, S.R.5    Brédas, J.L.6
  • 159
    • 0001370494 scopus 로고
    • A theoretical analysis of the two-photon properties of linear polyenes and the visual chromophores
    • Birge, R. R. and B. M. Pierce (1979) A theoretical analysis of the two-photon properties of linear polyenes and the visual chromophores. J. Chem. Phys. 70, 165-178.
    • (1979) J. Chem. Phys. , vol.70 , pp. 165-178
    • Birge, R.R.1    Pierce, B.M.2


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