Momentum space functions for polymers
Calais, J L, Defranceschi, M, Fripiat, J G, Delhalle, J
Published in Journal of physics. Condensed matter (29.06.1992)
Published in Journal of physics. Condensed matter (29.06.1992)
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3,5,11,13-Tetraazacycl[3.3.3]azine: theoretical (ab initio) and experimental (x-ray and ultraviolet photoelectron spectroscopy) studies of the electronic structure
Boutique, J. P, Verbist, J. J, Fripiat, J. G, Delhalle, J, Pfister-Guillouzo, G, Ashwell, G. J
Published in Journal of the American Chemical Society (01.08.1984)
Published in Journal of the American Chemical Society (01.08.1984)
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Efficient electronic structure calculations for systems of one-dimensional periodicity with the restricted Hartree-Fock-linear combination of atomic orbitals method implemented in Fourier space
Flamant, I., Fripiat, J. G., Delhalle, J., Harris, Frank E.
Published in Theoretical chemistry accounts (16.08.2000)
Published in Theoretical chemistry accounts (16.08.2000)
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A nonempirical molecular orbital study of the siting and pairing of aluminum in ferrierite
Fripiat, J. G, Galet, P, Delhalle, J, Andre, J. M, Nagy, J. B, Derouane, E. G
Published in Journal of physical chemistry (1952) (01.05.1985)
Published in Journal of physical chemistry (1952) (01.05.1985)
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Numerical orbital Fourier space approach to polymer band-structure calculations
Talman, J. D., Delhalle, J., Fripiat, J. G.
Published in International journal of quantum chemistry (05.11.2009)
Published in International journal of quantum chemistry (05.11.2009)
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Electronic structure of 3,7-diphenyl- and 3,7-bis(dimethylamino)-1,5-dithia-2,4,6,8-tetrazocines: ab initio calculations and photoelectron spectra
Boutique, J. P, Riga, J, Verbist, J. J, Delhalle, J, Fripiat, J. G, Haddon, R. C, Kaplan, M. L
Published in Journal of the American Chemical Society (01.01.1984)
Published in Journal of the American Chemical Society (01.01.1984)
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Electronic structure of naphtho[1,8-cd:4,5-c'd']bis[1,2,6]thia- and -selenadiazines. Ab initio calculations and photoelectron spectra
Boutique, J. P, Riga, J, Verbist, J. J, Delhalle, J, Fripiat, J. G, Andre, J. M, Haddon, R. C, Kaplan, M. L
Published in Journal of the American Chemical Society (01.05.1982)
Published in Journal of the American Chemical Society (01.05.1982)
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Condensed five-membered heterocycles with potentialities as conducting polymers: ab initio electronic structures and theoretical valence X-ray photoelectron spectra
LAZZARONI, R, BOUTIQUE, J. P, RIGA, J, VERBIST, J. J, FRIPIAT, J. G, DELHALLE, J
Published in Journal of the Chemical Society, Perkin Transactions 2 (1985)
Published in Journal of the Chemical Society, Perkin Transactions 2 (1985)
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