1 |
2020 |
ABINIT: Overview and focus on selected capabilities. |
DFPT, PAWs |

2 |
2020 |
Bethe-Salpeter Equation at the Critical End Point of the Mott Transition. |
--- |

3 |
2020 |
Efficient Formulation of Ab Initio Quantum Embedding in Periodic Systems: Dynamical Mean-Field Theory. |
--- |

4 |
2020 |
Evolution of the Kondo lattice electronic structure above the transport coherence temperature. |
ARPES, CEF |

5 |
2020 |
Extended Falicov-Kimball model: Hartree-Fock vs DMFT approach. |
HFA |

6 |
2020 |
ONETEP + TOSCAM: Uniting Dynamical Mean Field Theory and Linear-Scaling Density Functional Theory. |
DFT |

7 |
2019 |
Electronic correlations in dense iron: from moderate pressure to Earth's core conditions. |
EIC |

8 |
2019 |
Low dimensions electron localization in the beyond real space super cell approximation. |
CPA, DCA, FBZ |

9 |
2019 |
Nonequilibrium Steady States in Fluid Transport through Mesopores: Dynamic Mean Field Theory and Nonequilibrium Molecular Dynamics. |
GCMD |

10 |
2018 |
A comparison of dynamic mean field theory and grand canonical molecular dynamics for the dynamics of pore filling and capillary condensation of fluids in mesopores. |
GCMD |

11 |
2018 |
A unified and efficient theory for the structural properties of actinides and phases of plutonium. |
DFT, GGA |

12 |
2018 |
Emergence of Kondo Resonance in Graphene Intercalated with Cerium. |
ARPES, Ce |

13 |
2017 |
Coulomb correlations in 4d and 5d oxides from first principles-or how spin-orbit materials choose their effective orbital degeneracies. |
--- |

14 |
2017 |
Doublon-Holon Origin of the Subpeaks at the Hubbard Band Edges. |
--- |

15 |
2017 |
Dramatically Enhanced Superconductivity in Elemental Bismuth from Excitonic Fluctuation Exchange. |
TB |

16 |
2017 |
Localized-itinerant dichotomy and unconventional magnetism in SrRu2O6. |
DFT |

17 |
2017 |
Metal-Insulator Transition and Topological Properties of Pyrochlore Iridates. |
DFT |

18 |
2017 |
Nonadiabatic exchange-correlation kernel for strongly correlated materials. |
fs, TDDFT |

19 |
2016 |
Local electron-electron interaction strength in ferromagnetic nickel determined by spin-polarized positron annihilation. |
LSDA |

20 |
2016 |
Non-linear quantum-classical scheme to simulate non-equilibrium strongly correlated fermionic many-body dynamics. |
--- |

21 |
2016 |
Paramagnetic properties of Fe-Mn and Fe-V alloys: a DMFT study. |
CPA |

22 |
2015 |
Dynamical Mean-Field Theory Plus Numerical Renormalization-Group Study of Spin-Orbital Separation in a Three-Band Hund Metal. |
--- |

23 |
2015 |
Reliability of the one-crossing approximation in describing the Mott transition. |
OCA, QMC |

24 |
2015 |
[Correlation between children's dental decay and the contents of saliva CCL28 and secretory immunoglobulin A]. |
sIgA |

25 |
2014 |
Dynamic mean field theory for lattice gas models of fluids confined in porous materials: higher order theory based on the Bethe-Peierls and path probability method approximations. |
PPM |

26 |
2014 |
Investigation of real materials with strong electronic correlations by the LDA+DMFT method. |
LDA, MIT |

27 |
2014 |
Odd-parity triplet superconducting phase in multiorbital materials with a strong spin-orbit coupling: application to doped Sr₂IrO₄. |
CTQMC, SOC |

28 |
2013 |
Atomically resolved spectroscopic study of Sr2IrO4: experiment and theory. |
DFT, STM/S, TN |

29 |
2013 |
Dynamic mean field theory for lattice gas models of fluid mixtures confined in mesoporous materials. |
--- |

30 |
2013 |
Dynamics of capillary condensation in lattice gas models of confined fluids: a comparison of dynamic mean field theory with dynamic Monte Carlo simulations. |
DMC |

31 |
2013 |
Nonequilibrium dynamical mean-field theory: an auxiliary quantum master equation approach. |
--- |

32 |
2013 |
Quasi-continuous-time impurity solver for the dynamical mean-field theory with linear scaling in the inverse temperature. |
--- |

33 |
2012 |
Advantages of mass-imbalanced ultracold fermionic mixtures for approaching quantum magnetism in optical lattices. |
--- |

34 |
2012 |
Dynamical mean-field theory for molecules and nanostructures. |
DFT |

35 |
2012 |
Effect of spin-orbit coupling on the actinide dioxides AnO2 (An=Th, Pa, U, Np, Pu, and Am): a screened hybrid density functional study. |
HSE, SIC, SOC |

36 |
2012 |
Quantum critical phase and Lifshitz transition in an extended periodic Anderson model. |
--- |

37 |
2012 |
Temperature and bath size in exact diagonalization dynamical mean field theory. |
--- |

38 |
2011 |
Critical properties of the half-filled Hubbard model in three dimensions. |
--- |

39 |
2011 |
Dynamical mean-field theory from a quantum chemical perspective. |
--- |

40 |
2011 |
Fast multi-orbital equation of motion impurity solver for dynamical mean field theory. |
EOMs |

41 |
2011 |
Size control of charge-orbital order in half-doped manganite La0.5Ca0.5MnO3. |
DFT |

42 |
2010 |
CeFePO: f-d hybridization and quenching of superconductivity. |
LDA |

43 |
2009 |
Dynamical self-arrest in symmetric and asymmetric diblock copolymer melts using a replica approach within a local theory. |
--- |

44 |
2008 |
Bandstructure meets many-body theory: the LDA+DMFT method. |
DFT |

45 |
2008 |
Cluster dynamical mean field theory of the Mott transition. |
--- |

46 |
2008 |
Electronic coherence in delta-Pu: a dynamical mean-field theory study. |
--- |

47 |
2008 |
Non-Fermi-liquid behavior in the periodic anderson model. |
--- |

48 |
2008 |
Proceedings of the Second Workshop on Theory meets Industry (Erwin-Schrodinger-Institute (ESI), Vienna, Austria, 12-14 June 2007). |
DFT, ESF, ESI, VASP |

49 |
2007 |
Band calculations for 4f systems based on the dynamical mean field theory. |
CFS, SOI |

50 |
2006 |
Can correlations drive a band insulator metallic? |
--- |

51 |
2004 |
Cluster dynamical mean field analysis of the mott transition. |
--- |

52 |
2003 |
Orbital switching and the first-order insulator-metal transition in paramagnetic V2O3. |
LDA, MIT |

53 |
2002 |
Compressibility divergence and the finite temperature Mott transition. |
--- |

54 |
2001 |
Mott-hubbard metal-insulator transition in paramagnetic V2O3: an LDA+DMFT(QMC) study. |
LDA, QMC |

55 |
2000 |
Effect of long range coulomb interactions on the mott transition |
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