4.7 Article

Ab initio Quantum Monte Carlo Calculations of Spin Superexchange in Cuprates: The Benchmarking Case of Ca2CuO3

Related references

Note: Only part of the references are listed.
Article Multidisciplinary Sciences

Towards an exact description of electronic wavefunctions in real solids

George H. Booth et al.

NATURE (2013)

Article Materials Science, Multidisciplinary

Quantum Monte Carlo applied to solids

Luke Shulenburger et al.

PHYSICAL REVIEW B (2013)

Article Multidisciplinary Sciences

Spin-orbital separation in the quasi-one-dimensional Mott insulator Sr2CuO3

J. Schlappa et al.

NATURE (2012)

Article Materials Science, Multidisciplinary

Strain-driven spin-state transition and superexchange interaction in LaCoO3: Ab initio study

Hosung Seo et al.

PHYSICAL REVIEW B (2012)

Article Materials Science, Multidisciplinary

Diffusion quantum Monte Carlo study of the equation of state and point defects in aluminum

Randolph Q. Hood et al.

PHYSICAL REVIEW B (2012)

Proceedings Paper Physics, Multidisciplinary

Hybrid algorithms in quantum Monte Carlo

Jeongnim Kim et al.

IUPAP C20 CONFERENCE ON COMPUTATIONAL PHYSICS (CCP 2011) (2012)

Article Computer Science, Interdisciplinary Applications

Accurate pseudopotential description of the GW bandstructure of ZnO

H. Dixit et al.

COMPUTER PHYSICS COMMUNICATIONS (2011)

Article Physics, Condensed Matter

The quasiparticle band structure of zincblende and rocksalt ZnO

H. Dixit et al.

JOURNAL OF PHYSICS-CONDENSED MATTER (2010)

Article Physics, Multidisciplinary

Fundamental High-Pressure Calibration from All-Electron Quantum Monte Carlo Calculations

K. P. Esler et al.

PHYSICAL REVIEW LETTERS (2010)

Review Physics, Condensed Matter

QUANTUM ESPRESSO: a modular and open-source software project for quantum simulations of materials

Paolo Giannozzi et al.

JOURNAL OF PHYSICS-CONDENSED MATTER (2009)

Article Physics, Multidisciplinary

Effect of covalent bonding on magnetism and the missing neutron intensity in copper oxide compounds

Andrew C. Walters et al.

NATURE PHYSICS (2009)

Article Physics, Multidisciplinary

Nature and Strength of Interlayer Binding in Graphite

Leonardo Spanu et al.

PHYSICAL REVIEW LETTERS (2009)

Article Materials Science, Multidisciplinary

Problems with reconciling density functional theory calculations with experiment in ferropnictides

I. I. Mazin et al.

PHYSICAL REVIEW B (2008)

Article Materials Science, Multidisciplinary

Arsenic-bridged antiferromagnetic superexchange interactions in LaFeAsO

Fengjie Ma et al.

PHYSICAL REVIEW B (2008)

Article Physics, Multidisciplinary

Quantum Monte Carlo Calculations of Structural Properties of FeO Under Pressure

Jindrich Kolorenc et al.

PHYSICAL REVIEW LETTERS (2008)

Article Physics, Applied

Magnetic ordering in Gd monopnictides: Indirect exchange versus superexchange interaction

CG Duan et al.

APPLIED PHYSICS LETTERS (2006)

Article Materials Science, Multidisciplinary

Electronic structure and magnetic interactions of the spin-chain compounds Ca2CuO3 and Sr2CuO3

C de Graaf et al.

PHYSICAL REVIEW B (2001)

Review Physics, Multidisciplinary

Quantum Monte Carlo simulations of solids

WMC Foulkes et al.

REVIEWS OF MODERN PHYSICS (2001)