Hund's physics and the magnetic ground state of CrOX (X=Cl,Br)

Room temperature ferromagnetism in ultra-thin van der Waals crystals of 1T-CrTe2

(2020) Xingdan Sun et al.   Nano Research

A family of high-temperature ferromagnetic monolayers with locked spin-dichroism-mobility anisotropy: MnNX and CrCX (X = Cl, Br, I; C = S, Se, Te)

(2019) Cong Wang et al.   Science Bulletin

Microscopic understanding of magnetic interactions in bilayer CrI3

(2019) Seung Woo Jang et al.   PHYSICAL REVIEW MATERIALS

Intrinsic Van Der Waals Magnetic Materials from Bulk to the 2D Limit: New Frontiers of Spintronics

(2019) Hui Li et al.   ADVANCED MATERIALS

Magnetic 2D materials and heterostructures

(2019) M. Gibertini et al.   Nature Nanotechnology

Super-exchange theory for polyvalent anion magnets

(2019) Fang Zhang et al.   NEW JOURNAL OF PHYSICS

Magnetism and Optical Anisotropy in van der Waals Antiferromagnetic Insulator CrOCl

(2019) Tianle Zhang et al.   ACS Nano

Jx: An open-source software for calculating magnetic interactions based on magnetic force theory

(2019) Hongkee Yoon et al.   COMPUTER PHYSICS COMMUNICATIONS

Wannier90 as a community code: new features and applications

(2019) Giovanni Pizzi et al.   JOURNAL OF PHYSICS-CONDENSED MATTER

2D Intrinsic Ferromagnets from van der Waals Antiferromagnets

(2018) Naihua Miao et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Electric-field switching of two-dimensional van der Waals magnets

(2018) Shengwei Jiang et al.   NATURE MATERIALS

Controlling magnetism in 2D CrI3 by electrostatic doping

(2018) Shengwei Jiang et al.   Nature Nanotechnology

Electrical control of 2D magnetism in bilayer CrI3

(2018) Bevin Huang et al.   Nature Nanotechnology

Two-dimensional materials from high-throughput computational exfoliation of experimentally known compounds

(2018) Nicolas Mounet et al.   Nature Nanotechnology

Strong room-temperature ferromagnetism in VSe2 monolayers on van der Waals substrates

(2018) Manuel Bonilla et al.   Nature Nanotechnology

Giant tunneling magnetoresistance in spin-filter van der Waals heterostructures

(2018) Tiancheng Song et al.   SCIENCE

Probing magnetism in 2D van der Waals crystalline insulators via electron tunneling

(2018) D. R. Klein et al.   SCIENCE

The effect of double counting, spin density, and Hund interaction in the different DFT+U functionals

(2018) Siheon Ryee et al.   Scientific Reports

Gate-tunable room-temperature ferromagnetism in two-dimensional Fe3GeTe2

(2018) Yujun Deng et al.   NATURE

Magnetism in two-dimensional van der Waals materials

(2018) Kenneth S. Burch et al.   NATURE

Discovery of intrinsic ferromagnetism in two-dimensional van der Waals crystals

(2017) Cheng Gong et al.   NATURE

Layer-dependent ferromagnetism in a van der Waals crystal down to the monolayer limit

(2017) Bevin Huang et al.   NATURE

Opportunities and challenges of 2D magnetic van der Waals materials: magnetic graphene?

(2016) Je-Geun Park   JOURNAL OF PHYSICS-CONDENSED MATTER

Direct theoretical evidence for weaker correlations in electron-doped and Hg-based hole-doped cuprates

(2016) Seung Woo Jang et al.   Scientific Reports

Ferromagnetism in layered metastable 1T-CrTe2

(2015) Daniele C Freitas et al.   JOURNAL OF PHYSICS-CONDENSED MATTER

Density functional versus spin-density functional and the choice of correlated subspace in multivariable effective action theories of electronic structure

(2015) Hyowon Park et al.   PHYSICAL REVIEW B

van der Waals forces in density functional theory: a review of the vdW-DF method

(2015) Kristian Berland et al.   REPORTS ON PROGRESS IN PHYSICS

An updated version of wannier90: A tool for obtaining maximally-localised Wannier functions

(2014) Arash A. Mostofi et al.   COMPUTER PHYSICS COMMUNICATIONS

First-principles calculations of dynamical screened interactions for the transition metal oxidesMO (M=Mn, Fe, Co, Ni)

(2013) R. Sakuma et al.   PHYSICAL REVIEW B

Effect of the damping function in dispersion corrected density functional theory

(2011) Stefan Grimme et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY

Effective Coulomb interaction in transition metals from constrained random-phase approximation

(2011) Ersoy Şaşıoğlu et al.   PHYSICAL REVIEW B

A consistent and accurate ab initio parametrization of density functional dispersion correction (DFT-D) for the 94 elements H-Pu

(2010) Stefan Grimme et al.   JOURNAL OF CHEMICAL PHYSICS

Observation of strong magnetoelastic coupling in a first-order phase transition of CrOCl

(2009) Joachim Angelkort et al.   PHYSICAL REVIEW B