Types of single particle symmetry breaking in transition metal oxides due to electron correlation

Approaching chemical accuracy with quantum Monte Carlo

(2012) F. R. Petruzielo et al.   JOURNAL OF CHEMICAL PHYSICS

Transition-metal dioxides: A case for the intersite term in Hubbard-model functionals

(2011) Heather J. Kulik et al.   JOURNAL OF CHEMICAL PHYSICS

Multireference Character for 3d Transition-Metal-Containing Molecules

(2011) Wanyi Jiang et al.   Journal of Chemical Theory and Computation

Electrodynamics of correlated electron materials

(2011) D. N. Basov et al.   REVIEWS OF MODERN PHYSICS

Systematic study of first-row transition-metal diatomic molecules: A self-consistent DFT+U approach

(2010) Heather J. Kulik et al.   JOURNAL OF CHEMICAL PHYSICS

Wave functions for quantum Monte Carlo calculations in solids: Orbitals from density functional theory with hybrid exchange-correlation functionals

(2010) Jindřich Kolorenč et al.   PHYSICAL REVIEW B

First-principles modeling of localizeddstates with theGW@LDA+Uapproach

(2010) Hong Jiang et al.   PHYSICAL REVIEW B

QWalk: A quantum Monte Carlo program for electronic structure

(2009) Lucas K. Wagner et al.   JOURNAL OF COMPUTATIONAL PHYSICS

Quantum Monte Carlo Calculations of Structural Properties of FeO Under Pressure

(2008) Jindřich Kolorenč et al.   PHYSICAL REVIEW LETTERS

Unconventional Pairing Originating from the Disconnected Fermi Surfaces of SuperconductingLaFeAsO1−xFx

(2008) Kazuhiko Kuroki et al.   PHYSICAL REVIEW LETTERS