Philippe Millie: search on Z-Library

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1

Continuous-time Monte Carlo methods for quantum impurity models

Gull, Emanuel, Millis, Andrew, Lichtenstein, Alexander, Rubtsov, Alexey, Troyer, Matthias, Werner, Philipp

Journal:

Review of Modern Physics

Year:

2011

Language:

english

File:

PDF, 6.61 MB

english, 2011

2

Electronic structure of nitrogen square planar copper complexes in Langmuir-Blodgett films

Stéphane Carniato, Henri Roulet, Georges Dufour, Serge Palacin, André Barraud, Philippe Millié, Irène Nenner

Journal:

Thin Solid Films

Year:

1992

Language:

english

File:

PDF, 145 KB

english, 1992

3

Self-Association of Amphotericin B in Water. Theoretical Energy and Spectroscopy Studies

Millié, Philippe, Langlet, Jacqueline, Bergès, Jacqueline, Caillet, Jacqueline, Demaret, Jean-Philippe

Journal:

Journal of Physical Chemistry B

Year:

1999

Language:

english

File:

PDF, 190 KB

english, 1999

4

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

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

Journal:

Molecular Physics

Year:

2000

Language:

english

File:

PDF, 986 KB

english, 2000

5

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:

Physical Review B

Year:

2009

Language:

english

File:

PDF, 444 KB

english, 2009

6

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

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

Journal:

Year:

2003

File:

PDF, 52 KB

2003

7

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

Emanuela Emanuele, Dimitra Markovitsi, Philippe Millié, Krystyna Zakrzewska

Journal:

Year:

2005

Language:

english

File:

PDF, 254 KB

english, 2005

8

Potential energy surfaces of HgH2

Anne Bernier, Philippe Millié

Journal:

Chemical Physics Letters

Year:

1987

Language:

english

File:

PDF, 476 KB

english, 1987

9

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:

Chemical Physics

Year:

1986

Language:

english

File:

PDF, 744 KB

english, 1986

10

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

Claudine Crépin, Philippe Millié

Journal:

Chemical Physics

Year:

1989

Language:

english

File:

PDF, 1.65 MB

english, 1989

11

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

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

Journal:

Chemical Physics

Year:

1993

Language:

english

File:

PDF, 1.24 MB

english, 1993

12

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:

Chemical Physics

Year:

1994

Language:

english

File:

PDF, 1.23 MB

english, 1994

13

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

Sylvie Marguet, Arnaud Germain, Philippe Millie

Journal:

Chemical Physics

Year:

1996

Language:

english

File:

PDF, 1.70 MB

english, 1996

14

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

Hartmut Palm, Christian Alcaraz, Philippe Millié, Odile Dutuit

Journal:

International Journal of Mass Spectrometry

Year:

2006

Language:

english

File:

PDF, 351 KB

english, 2006

15

Continuous-time quantum impurity solvers

Emanuel Gull, Philipp Werner, Andrew Millis, Matthias Troyer

Journal:

Physics Procedia

Year:

2010

Language:

english

File:

PDF, 293 KB

english, 2010

16

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

Year:

1999

Language:

english

File:

PDF, 164 KB

english, 1999

17

Étude théorique des réactions de coupure de quelques composés magnésiens typiques

Maurice Astier, Philippe Millié

Journal:

Journal of Organometallic Chemistry

Year:

1973

File:

PDF, 225 KB

1973

18

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

Year:

1971

File:

PDF, 579 KB

1971

19

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

André Barraud, Philippe Millie, Irina Yakimenko

Journal:

Materials Science and Engineering: C

Year:

1998

Language:

english

File:

PDF, 326 KB

english, 1998

20

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

Philippe Millie, Gaston Berthier

Journal:

International Journal of Quantum Chemistry

Year:

1968

Language:

english

File:

PDF, 320 KB

english, 1968

21

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

Fabienne Maeder, Philippe Millie, Gaston Berthier

Journal:

International Journal of Quantum Chemistry

Year:

1970

Language:

english

File:

PDF, 306 KB

english, 1970

22

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

Philippe Millie, Lionel Praud, Josiane Serre

Journal:

International Journal of Quantum Chemistry

Year:

1970

Language:

english

File:

PDF, 256 KB

english, 1970

23

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

Philippe Millié, Bernard Lévy, Gaston Berthier

Journal:

International Journal of Quantum Chemistry

Year:

1972

Language:

english

File:

PDF, 604 KB

english, 1972

24

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

Lionel Praud, Bernard Levy, Philippe Millie, Gaston Berthier

Journal:

International Journal of Quantum Chemistry

Year:

1973

Language:

english

File:

PDF, 365 KB

english, 1973

25

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

Gilberte Chambaud, Bernard Levy, Philippe Millie

Journal:

Journal of Materials Science

Year:

1972

Language:

english

File:

PDF, 780 KB

english, 1972

26

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)

Year:

1968

File:

PDF, 261 KB

1968

27

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)

Year:

1978

Language:

english

File:

PDF, 780 KB

english, 1978

28

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:

Year:

2012

Language:

english

File:

PDF, 947 KB

english, 2012

29

Continuous-Time Solver for Quantum Impurity Models

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

Journal:

Physical Review Letters

Year:

2006

Language:

english

File:

PDF, 274 KB

english, 2006

30

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

Year:

2000

Language:

english

File:

PDF, 114 KB

english, 2000

31

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

Year:

2010

Language:

english

File:

PDF, 69 KB

english, 2010

32

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

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

Journal:

Physical Review B

Year:

2009

Language:

english

File:

PDF, 209 KB

english, 2009

33

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

Bertolus, Marjorie, Finocchi, Fabio, Millié, Philippe

Journal:

The Journal of Chemical Physics

Year:

2004

Language:

english

File:

PDF, 1.01 MB

english, 2004

34

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

DELHOMMELLE, JÉRÔME, MILLIÉ, PHILIPPE

Journal:

Molecular Physics

Year:

2001

Language:

english

File:

PDF, 542 KB

english, 2001

35

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)

Year:

1978

Language:

english

File:

PDF, 780 KB

english, 1978

36

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

Werner, Philipp, Millis, Andrew J.

Journal:

Physical Review B

Year:

2006

Language:

english

File:

PDF, 317 KB

english, 2006

37

Triphenylene Columnar Liquid Crystals: Excited States and Energy Transfer

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

Journal:

Journal of Physical Chemistry

Year:

1995

Language:

english

File:

PDF, 1.45 MB

english, 1995

38

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

Year:

2008

Language:

english

File:

PDF, 256 KB

english, 2008

39

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:

Journal of Physical Chemistry B

Year:

1998

Language:

english

File:

PDF, 319 KB

english, 1998

40

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

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

Journal:

Journal of Physical Chemistry A

Year:

1998

Language:

english

File:

PDF, 484 KB

english, 1998

41

Dimers of Triarylpyrylium Salts: Geometry and Electronic Transitions

Lampre, Isabelle, Markovitsi, Dimitra, Millié, Philippe

Journal:

Journal of Physical Chemistry A

Year:

1997

Language:

english

File:

PDF, 292 KB

english, 1997

42

Investigation of the Photoionization Mechanism of Small Aromatic Homoclusters

Bouvier, Benjamin, Millié, Philippe, Mons, Michel

Journal:

Journal of Physical Chemistry A

Year:

2004

Language:

english

File:

PDF, 119 KB

english, 2004

43

Influence of Conformational Dynamics on the Exciton States of DNA Oligomers

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

Journal:

Journal of Physical Chemistry B

Year:

2003

Language:

english

File:

PDF, 581 KB

english, 2003

44

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

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

Journal:

Journal of Physical Chemistry A

Year:

2002

Language:

english

File:

PDF, 549 KB

english, 2002

45

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

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

Journal:

Physical Review B

Year:

2010

Language:

english

File:

PDF, 413 KB

english, 2010

46

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:

Journal of Medicinal Chemistry

Year:

1968

Language:

english

File:

PDF, 546 KB

english, 1968

47

Exciton States of Dynamic DNA Double Helices: Alternating dCdG Sequences

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

Journal:

Journal of Physical Chemistry B

Year:

2005

Language:

english

File:

PDF, 806 KB

english, 2005

48

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

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

Journal:

Journal of Physical Chemistry A

Year:

1998

Language:

english

File:

PDF, 157 KB

english, 1998

49

Electronic structure of nitrogen square planar copper complexes in Langmuir-Blodgett films

Carniato, Stephane, Roulet, Henri, Dufour, Georges, Palacin, Serge, Barraud, Andre, Millie, Philippe, Nenner, Irene

Journal:

Journal of Physical Chemistry

Year:

1992

Language:

english

File:

PDF, 527 KB

english, 1992

50

High-Spin to Low-Spin and Orbital Polarization Transitions in Multiorbital Mott Systems

Werner, Philipp, Millis, Andrew J.

Journal:

Physical Review Letters

Year:

2007

Language:

english

File:

PDF, 227 KB

english, 2007

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