화학공학소재연구정보센터
검색결과 : 6건
No. Article
1 Electronic Band Structure of Helical Polyisocyanides
Charnpagne B, Liegeois V, Fripiat JG, Harris FE
Journal of Physical Chemistry A, 121(41), 7993, 2017
2 Fourier representation methods for Moller-Plesset perturbation theory in one-dimensionally periodic systems
Fripiat JG, Delhalle J, Harris FE
Chemical Physics Letters, 422(1-3), 11, 2006
3 MP2 correlation effects upon the electronic and vibrational properties of polyyne
Poulsen TD, Mikkelsen KV, Fripiat JG, Jacquemin D, Champagne B
Journal of Chemical Physics, 114(13), 5917, 2001
4 Unrestricted Hartree-Fock band structure calculations for polymers: Application to a cross-talk system
Poulsen TD, Mikkelsen KV, Fripiat JG, Champagne B
Journal of Chemical Physics, 113(14), 5958, 2000
5 Size Consistency and Size Extensivity of Linear-Response Properties Using the Perturbed Electron Propagator - Comment
Champagne B, Mosley DH, Fripiat JG, Andre JM, Ohm Y
Journal of Chemical Physics, 104(3), 1166, 1996
6 Fourier Representation Method for Accurate Evaluation of the Coulomb and Exchange Lattice Sums in Extended Chains
Delhalle J, Cizek J, Flamant I, Calais JL, Fripiat JG
Journal of Chemical Physics, 101(12), 10717, 1994