Philippe Millie : rechercher sur Z-Library

DELHOMMELLE, JÉRÔME, MILLIÉ, PHILIPPE, FUCHS, ALAIN H.

Année:

1999

Langue:

english

Fichier:

PDF, 190 KB

english, 1999

On the role of the definition of potential models in Gibbs ensemble phase equilibria simulations of the H 2 S-pentane mixture

Journal:

Molecular Physics

Année:

2000

Langue:

english

Fichier:

PDF, 986 KB

english, 2000

Momentum-sector-selective metal-insulator transition in the eight-site dynamical mean-field approximation to the Hubbard model in two dimensions

Gull, Emanuel, Parcollet, Olivier, Werner, Philipp, Millis, Andrew J.

Journal:

Giovanni Granucci, Thu-Hoa Tran-Thi, Thomas Gustavsson, Philippe Millie, James T. Hynes

Année:

2009

Langue:

english

Fichier:

PDF, 444 KB

english, 2009

New Theoretical Ideas for an Old Problem: Excited State Proton Transfer in Solution

Journal:

ChemInform

Année:

2003

Fichier:

PDF, 52 KB

2003

UV Spectra and Excitation Delocalization in DNA: Influence of the Spectral Width

Emanuela Emanuele, Dimitra Markovitsi, Philippe Millié, Krystyna Zakrzewska

Journal:

ChemPhysChem

Année:

2005

Langue:

english

Fichier:

PDF, 254 KB

english, 2005

Potential energy surfaces of HgH2

Anne Bernier, Philippe Millié

Journal:

Chemical Physics Letters

Année:

1987

Langue:

english

Fichier:

PDF, 476 KB

english, 1987

Three-electron approach of HgH using relativistic effective core, core polarization and spin-orbit operators: the low-lying states

Anne Bernier, Philippe Millié, Michel Pelissier

Journal:

Claudine Crépin, Philippe Millié

Année:

1986

Langue:

english

Fichier:

PDF, 744 KB

english, 1986

Mechanism of Hg(3P) relaxation in nitrogen matrices. I. Theoretical study of HgN2

Journal:

Carole Ecoffet, Dimitra Markovitsi, Philippe Millié, Jean-Pierre Lemaistre

Année:

1989

Langue:

english

Fichier:

PDF, 1.65 MB

english, 1989

Electronic excitations in organized molecular systems. A model for columnar aggregates of ionic compounds

Journal:

Année:

1993

Langue:

english

Fichier:

PDF, 1.24 MB

english, 1993

Charge transfer in triaryl pyrylium cations. Theoretical and experimental study

Dimitra Markovitsi, hervé Sigal, Carole Ecoffet, Philippe Millié, Fabrice Charra, Céline Fiorini, Jean-Michel Nunzi, Hélèna Strzelecka, Michèle Veber, Colette Jallabert

Journal:

Sylvie Marguet, Arnaud Germain, Philippe Millie

Année:

1994

Langue:

english

Fichier:

PDF, 1.23 MB

english, 1994

Electronic states of multichromophoric phenylethynylbenzene derivatives: exciton theory and CS-INDO-CIPSI calculations

Journal:

Hartmut Palm, Christian Alcaraz, Philippe Millié, Odile Dutuit

Année:

1996

Langue:

english

Fichier:

PDF, 1.70 MB

english, 1996

State-selected C2H2+ + C2H4 reaction: Controlled by dynamics or statistics?

Journal:

International Journal of Mass Spectrometry

Année:

2006

Langue:

english

Fichier:

PDF, 351 KB

english, 2006

Continuous-time quantum impurity solvers

Emanuel Gull, Philipp Werner, Andrew Millis, Matthias Troyer

Journal:

Physics Procedia

Année:

2010

Langue:

english

Fichier:

PDF, 293 KB

english, 2010

Electronic coupling responsible for energy transfer in columnar liquid crystals

Dimitra Markovitsi, Sylvie Marguet, Lazaros K Gallos, Hervé Sigal, Philippe Millié, Panos Argyrakis, Helmut Ringsdorf, Sandeep Kumar

Journal:

Chemical Physics Letters

Année:

1999

Langue:

english

Fichier:

PDF, 164 KB

english, 1999

Étude théorique des réactions de coupure de quelques composés magnésiens typiques

Maurice Astier, Philippe Millié

Journal:

Journal of Organometallic Chemistry

Année:

1973

Fichier:

PDF, 225 KB

1973

Étude théorique de la structure électronique et des énergies de formation de quelques composés magnésiens typiques

Maurice Astier, Philippe Millie

Journal:

Journal of Organometallic Chemistry

Année:

1971

Fichier:

PDF, 579 KB

1971

Tunnel electron transport in metal/Langmuir-Blodgett film/metal systems

André Barraud, Philippe Millie, Irina Yakimenko

Journal:

Materials Science and Engineering: C

Année:

1998

Langue:

english

Fichier:

PDF, 326 KB

english, 1998

All-electron calculations of open-shell polyatomic molecules I. SCF wave function in gaussians for methyl and vinyl radicals

Philippe Millie, Gaston Berthier

Journal:

Fabienne Maeder, Philippe Millie, Gaston Berthier

Année:

1968

Langue:

english

Fichier:

PDF, 320 KB

english, 1968

All-electron calculations of open-shell polyatomic molecules: II. Construction of quasi-localized molecular orbitals in vinyl and formaldiminoxyl radicals

Journal:

Philippe Millie, Lionel Praud, Josiane Serre

Année:

1970

Langue:

english

Fichier:

PDF, 306 KB

english, 1970

The nature of the “triple bond” of 1,2-benzyne

Journal:

Philippe Millié, Bernard Lévy, Gaston Berthier

Année:

1970

Langue:

english

Fichier:

PDF, 256 KB

english, 1970

All electron calculations of open-shell polyatomic molecules. III. Perturbation treatment of the spin polarization in vinyl and methyl radicals

Journal:

Lionel Praud, Bernard Levy, Philippe Millie, Gaston Berthier

Année:

1972

Langue:

english

Fichier:

PDF, 604 KB

english, 1972

Ab Initio second-order perturbation calculations for excited and ionized states of benzene isomers

Journal:

Gilberte Chambaud, Bernard Levy, Philippe Millie

Année:

1973

Langue:

english

Fichier:

PDF, 365 KB

english, 1973

Morphological verification of “Row nucleation” in isotactic polystyrene; evidence for single crystals within the bulk

Journal:

Journal of Materials Science

Année:

1972

Langue:

english

Fichier:

PDF, 780 KB

english, 1972

Structure électronique comparée des isomères conjugués du benzène

Lionel Praud, Philippe Millie, Gaston Berthier

Journal:

Theoretical Chemistry Accounts: Theory, Computation, and Modeling (Theoretica Chimica Acta)

Année:

1968

Fichier:

PDF, 261 KB

1968

Ab initioHartree-Fock instabilities in closed-shell molecular systems

Gilberte Chambaud, Bernard Levy, Philippe Millie

Journal:

Theoretical Chemistry Accounts: Theory, Computation, and Modeling (Theoretica Chimica Acta)

Année:

1978

Langue:

english

Fichier:

PDF, 780 KB

english, 1978

Satellites and large doping and temperature dependence of electronic properties in hole-doped BaFe2As2

Werner, Philipp, Casula, Michele, Miyake, Takashi, Aryasetiawan, Ferdi, Millis, Andrew J., Biermann, Silke

Journal:

Nature Physics

Année:

2012

Langue:

english

Fichier:

PDF, 947 KB

english, 2012

Continuous-Time Solver for Quantum Impurity Models

Werner, Philipp, Comanac, Armin, de’ Medici, Luca, Troyer, Matthias, Millis, Andrew

Journal:

Physical Review Letters

Année:

2006

Langue:

english

Fichier:

PDF, 274 KB

english, 2006

A Theoretical Investigation of Excited-State Acidity of Phenol and Cyanophenols

Granucci, Giovanni, Hynes, James T., Millié, Philippe, Tran-Thi, Thu-Hoa

Journal:

Journal of the American Chemical Society

Année:

2000

Langue:

english

Fichier:

PDF, 114 KB

english, 2000

DOPILL, AN ELECTRONIC PILL DISPENSER, HELPING EVALUATE AND CONTROL MEDICATION ADHERENCE IN PATIENTS WITH SCHIZOPHRENIA

Catherine Guevremont, Juliette Sablier, Millie Lum, Philippe Vincent, Constantin Tranulis, Frédérique Nadeau Marcotte, Emmanuel Stip

Journal:

Schizophrenia Research

Année:

2010

Langue:

english

Fichier:

PDF, 69 KB

english, 2010

Metal-insulator phase diagram and orbital selectivity in three-orbital models with rotationally invariant Hund coupling

Werner, Philipp, Gull, Emanuel, Millis, Andrew J.

Journal:

Bertolus, Marjorie, Finocchi, Fabio, Millié, Philippe

Année:

2009

Langue:

english

Fichier:

PDF, 209 KB

english, 2009

Investigating bonding in small silicon–carbon clusters: Exploration of the potential energy surfaces of Si[sub 3]C[sub 4], Si[sub 4]C[sub 3], and Si[sub 4]C[sub 4] using ab initio molecular dynamics

Journal:

The Journal of Chemical Physics

Année:

2004

Langue:

english

Fichier:

PDF, 1.01 MB

english, 2004

Inadequacy of the Lorentz-Berthelot combining rules for accurate predictions of equilibrium properties by molecular simulation

DELHOMMELLE, JÉRÔME, MILLIÉ, PHILIPPE

Journal:

Molecular Physics

Année:

2001

Langue:

english

Fichier:

PDF, 542 KB

english, 2001

Ab initioHartree-Fock instabilities in closed-shell molecular systems

Gilberte Chambaud, Bernard Levy, Philippe Millie

Journal:

Theoretical Chemistry Accounts: Theory, Computation, and Modeling (Theoretica Chimica Acta)

Année:

1978

Langue:

english

Fichier:

PDF, 780 KB

english, 1978

Hybridization expansion impurity solver: General formulation and application to Kondo lattice and two-orbital models

Werner, Philipp, Millis, Andrew J.

Journal:

Markovitsi, Dimitra, Germain, Arnaud, Millie, Philippe, Lecuyer, Pierre, Gallos, Lazaros, Argyrakis, Panos, Bengs, Holger, Ringsdorf, Helmut

Année:

2006

Langue:

english

Fichier:

PDF, 317 KB

english, 2006

Triphenylene Columnar Liquid Crystals: Excited States and Energy Transfer

Journal:

Journal of Physical Chemistry

Année:

1995

Langue:

english

Fichier:

PDF, 1.45 MB

english, 1995

Spin Freezing Transition and Non-Fermi-Liquid Self-Energy in a Three-Orbital Model

Werner, Philipp, Gull, Emanuel, Troyer, Matthias, Millis, Andrew J.

Journal:

Physical Review Letters

Année:

2008

Langue:

english

Fichier:

PDF, 256 KB

english, 2008

Influence of Disorder on Electronic Excited States: An Experimental and Numerical Study of Alkylthiotriphenylene Columnar Phases

Marguet, Sylvie, Markovitsi, Dimitra, Millié, Philippe, Sigal, Hervé, Kumar, Sandeep

Journal:

Courty, Alexa, Mons, Michel, Dimicoli, Iliana, Piuzzi, François, Gaigeot, Marie-Pierre, Brenner, Valérie, de Pujo, Patrick, Millié, Philippe

Année:

1998

Langue:

english

Fichier:

PDF, 319 KB

english, 1998

Quantum Effects in the Threshold Photoionization and Energetics of the Benzene−H 2 O and Benzene−D 2 O Complexes: Experiment and Simulation

Journal:

Lampre, Isabelle, Markovitsi, Dimitra, Millié, Philippe

Année:

1998

Langue:

english

Fichier:

PDF, 484 KB

english, 1998

Dimers of Triarylpyrylium Salts: Geometry and Electronic Transitions

Journal:

Bouvier, Benjamin, Millié, Philippe, Mons, Michel

Année:

1997

Langue:

english

Fichier:

PDF, 292 KB

english, 1997

Investigation of the Photoionization Mechanism of Small Aromatic Homoclusters

Journal:

Bouvier, Benjamin, Dognon, Jean-Pierre, Lavery, Richard, Markovitsi, Dimitra, Millié, Philippe, Onidas, Delphine, Zakrzewska, Krystyna

Année:

2004

Langue:

english

Fichier:

PDF, 119 KB

english, 2004

Influence of Conformational Dynamics on the Exciton States of DNA Oligomers

Journal:

Bouvier, Benjamin, Brenner, Valérie, Millié, Philippe, Soudan, Jean-Maïk

Année:

2003

Langue:

english

Fichier:

PDF, 581 KB

english, 2003

A Model Potential Approach to Charge Resonance Phenomena in Aromatic Cluster Ions

Journal:

Werner, Philipp, Oka, Takashi, Eckstein, Martin, Millis, Andrew J.

Année:

2002

Langue:

english

Fichier:

PDF, 549 KB

english, 2002

Weak-coupling quantum Monte Carlo calculations on the Keldysh contour: Theory and application to the current-voltage characteristics of the Anderson model

Journal:

Journal of Medicinal Chemistry

Année:

2010

Langue:

english

Fichier:

PDF, 413 KB

english, 2010

Researches in the indole series. XX. Quantum mechanical calculations and charge-transfer complexes of substituted indoles

Millie, Philippe, Malrieu, Jean P., Benaim, Jean, Lallemand, J. Y., Julia, Marc

Journal:

Année:

1968

Langue:

english

Fichier:

PDF, 546 KB

english, 1968

Exciton States of Dynamic DNA Double Helices: Alternating dCdG Sequences

Emanuele, Emanuela, Zakrzewska, Krystyna, Markovitsi, Dimitra, Lavery, Richard, Millié, Philippe

Journal:

Courty, Alexa, Mons, Michel, Dimicoli, Iliana, Piuzzi, François, Brenner, Valérie, Millié, Philippe

Année:

2005

Langue:

english

Fichier:

PDF, 806 KB

english, 2005

Ionization, Energetics, and Geometry of the Phenol−S Complexes (S = H 2 O, CH 3 OH, and CH 3 OCH 3 )

Journal: