Liste de publications

1. M. Schick, J. Schäfer, K. Kalki, G. Ceballos, P. Reinhardt, H. Hoffschulz, K. Wandelt, ``Miscibility within monolayer Ag-Cu films on Ru(0001)'', Surf.Sci. 287/288 (1993) 960
2. J. Schäfer, P. Reinhardt, H. Hoffschulz, K. Wandelt, ``Indirect Determination of Miscibility Properties of Monolayer Alloy Films by Simulation of Thermal Desorption Spectra: Ag-Cu/Ru(0001)'', Surf.Sci. 313 (1994) 83
3. P. Reinhardt, B. A. Heß, ``Electronic and Geometrical Structure of Rutile Surfaces'', Phys.Rev.B 50 (1994) 12015
4. P. Reinhardt, B. A. Heß, ``Electronic and Geometrical Structure of Bulk Rutile studied with Hartree-Fock and Density Functional Methods'', Int.J.Quant.Chem. 58 (1996) 297
5. P. Reinhardt, M. Causà, C. M. Marian, B. A. Heß, ``Adsorption of CO on TiO$_2$ (110) studied by means of a cluster model surrounded by multipoles obtained from slab calculations'', Phys.Rev.B 54 (1996) 14812
6. A. Povill, J. Rubio, J.-P. Malrieu, P. Reinhardt, ``Direct Determination of Localized Hartree-Fock Orbitals as a step towards N scaling procedures'', J.Chem.Phys. 107 (1997) 10044
7. P. Reinhardt, J.-P. Malrieu, A. Povill, J. Rubio, ``Localized Orbitals in Nonmetallic Ring Systems'', Int.J.Quant.Chem. 70 (1998) 167
8. P. Reinhardt, J.-P. Malrieu, ``On the Perturbative Estimates of the Correlation Energy from Localized Orbitals in Periodic Systems'', J.Chem.Phys. 109 (1998) 7632
9. M.Albrecht, P. Reinhardt, J.-P. Malrieu, ``Correlation Corrections to the Excited States of Periodic Systems Employing Wannier-type Orbitals'', Theor.Chem.Acc. 100 (1998) 241
10. P. Reinhardt, M.-P. Habas, R. Dovesi, I. de P. R. Moreira, F. Illas, ``On the Magnetic Coupling in the Weak Ferromagnet CuF$_2$'', Phys.Rev.B 59 (1999) 1016
11. P. Reinhardt, J.-P. Malrieu, ``Correlation Energies Obtained from Symmetry-Adapted vs. Symmetry-Broken Hartree-Fock Solutions in a Model Delocalized 1D System'', J.Chem.Phys. 110 (1999) 755
12. P. Reinhardt, I. de P. R. Moreira, C. de Graaf, F. Illas, R. Dovesi, ``Detailed Ab-initio analysis of the magnetic coupling in CuF$_2$'', Chem.Phys.Lett. 319 (2000) 625
13. R. Baxter, P. Reinhardt, N. Lopez, F. Illas, ``The extent of relaxation of the $\alpha$-Al$_2$O$_3$ (0001) surface and the reliability of empirical potentials'', Surf.Sci. 445 (2000) 448
14. P. Reinhardt, ``Dressed CEPA methods for Periodic Systems'', Theor.Chem.Accounts 104 (2000) 426
15. J. R. B. Gomes, I. de P. R. Moreira, P. Reinhardt, A. Wander, B. G. Searle, N. M. Harrison, F. Illas, ``The structural relaxation of the $\alpha$-Al$_2$O$_3$ (0001) surface -- An Investigation of Potential Errors'', Chem.Phys.Lett. 341 (2001) 412
16. J. Langlet, J. Caillet, J. Bergès, P. Reinhardt, ``Comparison of two ways to decompose intermolecular interactions for hydrogen-bonded dimer systems'', J.Chem.Phys. 118 (2003) 6157-6166
17. P. Reinhardt, ``The decomposition of intermolecular interaction energies in localized orbitals -- critical analysis and an invariance'', Chem.Phys.Lett. 370 (2003) 338-344
18. J. Langlet, J. Bergès, P. Reinhardt, ``Decomposition of intermolecular interactions: Comparison between SAPT and density-functional decompositions'', J.Mol.Struct: Theochem (en cours d'impression)
19. J. Langlet, J. Bergès, P. Reinhardt, ``An interesting property of the Perdew-Wang 91 density functional'', Chem.Phys.Lett. (accepté)
20. P. Reinhardt, ``The Anti-BSSE in dressed Epstein-Nesbet perturbation theory'', Theor.Chem.Accounts (envoyé)