Physical Review Materials

Article	Citations
Pressure dependence of electronic, vibrational and optical properties of wurtzite-boron nitride	103
Erratum: Bridging particle deformability and collective response in soft solids [Phys. Rev. Materials 5 , 055605 (2021)]	98
Correlation effects in two-dimensional MX2	94
Ultrathin freestanding membranes of ZrO2	74
La2O3	61
Ab initio tight-binding models for mono- and bilayer hexagonal boron nitride ( h -BN)	53
Controlling electronic properties of hexagonal manganites through aliovalent doping and thermoatmospheric history	52
Efficient electron doping into KTaO3 by hydrogen ion beam	51
Influence of solutes on the core structures of 〈a〉 -type sc	51
Linear nonsaturating magnetoresistance and superconductivity in epitaxial thin films of YbSb2	51
Pressure-driven solid–solid phase transformations of isotropic particles across diverse crystal structure types	49
DFT+U+V study of pristine	48
Machine-learning potential for phonon transport in AlN with defects in multiple charge states	48
Neuromorphic-like dynamics in percolating copper nanoparticle networks: Synthesis, characterization, and limitations	44
Low temperature phase of AuSn4 induced by the van der Waals interactions	44
Altermagnetic behavior in OsO2 : Parallels with 44
Trap-limited diffusion of Zn in β−Ga2	41
Influence of the octahedral cation on the evolution of lattice phonons in metal halide double perovskites: Raman spectroscopic investigation of 38
Atomic layer deposition of yttrium iron garnet thin films	37
First-principles study on structural, vibrational, elastic, piezoelectric, and electronic properties of the Janus Bi	36
Large intrinsic spin Hall conductivity in orthorhombic tungsten	36
Temperature-induced transformation between layered herringbone polymorphs in molecular bilayer organic semiconductors	36
Erratum: Machine learning for metallurgy III: A neural network potential for Al-Mg-Si [Phys. Rev. Materials 5 , 053805 (2021)]	36
Machine learning surrogate models for strain-dependent vibrational properties and migration rates of point defects	35
Pressure-induced superconductivity in quasi-one-dimensional semimetal Ta2	34

Low electronic conductivity of Li7La3	34
Simple machine-learned interatomic potentials for complex alloys	34
Yielding in multicomponent metallic glasses: Universal signatures of elastic modulus heterogeneities	34
Unfolding the band structure of van der Waals heterostructures	33
Molecular beam epitaxy of Sr5Au2<	33
Erratum: Anomalous band renormalization due to a high-energy kink in K	33
Phase field crystal modeling of grain boundary structures in diamond cubic systems	32
Abnormal temperature dependent elastic properties of fused silica irradiated by ultrafast lasers	32
Crystal morphing: Structural interpolation including crystal invariances	32
Resonance energy transfer from moiré-trapped excitons in MoSe	32
Effect of intrinsic point defects on the catalytic and electronic properties of Cu2	31
Machine learning prediction of thermodynamic and mechanical properties of multicomponent Fe-Cr-based alloys	31
Atomic structure, chemical composition, and oxidation behavior of the (001) surface of Ni2<	31
Theoretical prediction of two-dimensional II-V compounds	30
Cleavable quaternary oxychlorides with high magnetic ordering temperatures	30
Nonreciprocity in millimeter wave devices using a magnetic grating metamaterial	30
Large Seebeck coefficient driven by “pudding mold” flat band in hole-doped CuRhO2	30
Probabilistic deep learning approach for targeted hybrid organic-inorganic perovskites	29
Interpreting force response patterns of a mechanically driven crystallographic phase transition	29
Network approach for the analysis of the irreversible deformation of solids with soft heterogeneities	28
Generation and routing of nanoscale droplet solitons without compensation of magnetic damping	28
Untangling the structural, magnetic dipole, and charge multipolar orders in Ba2	27
NaNO3 monolayer: A stable graphenelike supersalt with strong four-phonon sca	27
Morphology of nanoporous glass: Stochastic 3D modeling, stereology and the influence of pore width	27
Editorial: To Review Is to Be	26
Analysis of lattice locations of deuterium in tungsten and its application for predicting deuterium trapping conditions	26
Magnetotransport and Berry phase tuning in Gd-doped Bi2Se	25
Avalanches during micro-galvanic corrosion of Mg-Cu-Al alloys in NaCl solution	25
Extreme mechanics of colloidal polymers under compression: Buckling, creep, and break-up	25
Strongly out-of-equilibrium growth morphologies in fast solidifying eutectics	25
YbNi4Mg : Superheavy fermion with enhan	25
Minimal and versatile description of diffusion and swelling in polymer-solvent systems: Modeling and experimental validation	25
Metal-insulator transition in n -type bulk crystals and films of strongly compensated 25
Extrapolation to the complete basis-set limit in density-functional theory using statistical learning	25
Determining ground states of alloys by a symmetry-based classification	24
Synergetic boost of functional properties near critical end points in antiferroelectric systems	24
Origin of polytypism in block copolymer materials	24
Electron count dictates phase separation in Heusler alloys	24
Magnetic order and spin liquid behavior in [Mo3	24
Deformation-induced medium-range order changes in bulk metallic glasses	24
Cr2S3	24
Computational evaluation of ScB and TiB MBenes as promising anode materials for high-performance metal-ion batteries	24
Exploring the correlation between the spin-state configuration and the magnetic order in Co-substituted BiFeO	22
Quasi-one-dimensional Pb5Re3	22
Stability, metallicity, and magnetism in niobium silicide nanofilms	22
Atomic level control of association-dissociation behavior of In impurities in polycrystalline ZnO	22
Pressure-induced loss of metallicity in RuO2	22
Angular-dependent interatomic potential for large-scale atomistic simulation of the Fe-Cr-H ternary system	22
Unconventional Landau level transitions in Weyl semimetal NbP	22
Expanding the window of the Frank-Kasper σ phase of block copolymer/homopolymer blend by selective incorporation	22

Effects of Ca2+	22
High-refractive-index materials screening from machine learning and ab initio methods	22
Fingerprinting soft material nanostructure response to complex flow histories	22
Boron nitride on SiC(0001)	22
Self-assembly of magnetic Co atoms on stanene	22
Efficient room-temperature magnetization direction detection by means of the enhanced anomalous Nernst effect in a Weyl ferromagnet	22
Deep machine learning potential for atomistic simulation of Fe-Si-O systems under Earth's outer core conditions	22
Specular inverse Faraday effect in transition metals	22
Contributions of bulk and surface energies in stabilizing metastable polymorphs: A comparative study of group 3 sesquioxides	21
Single crystal growth and thermoelectric properties of Nowotny chimney-ladder compound Fe2	21
Essential role of magnetic frustration in the phase diagrams of doped cobaltites	21
Kondo volume collapse in frustrated antiferromagnet: The case of Ce2	21
Highly confined, low-loss plasmonics based on two-dimensional solid-state defect lattices	21
Mechanism of local lattice distortion effects on vacancy migration barriers in fcc alloys	21
Thermoelectric properties of SnSe and SnSe2 single crystals	20
Metal-insulator transition and anomalous lattice parameters changes in Ru-doped VO2	20
Vacancy-tuned magnetism in LaMnxSb2	20
High-pressure effects on structural, magnetic, and vibrational properties of van der Waals antiferromagnet MnPS	20
Interplay of spin current and magnetization in a topological-insulator/magnetic-insulator bilayer structure	20
Theory of liquid-mediated strain release in two-dimensional materials	20
Useful strategy for assuming complex ordered phases possibly formed by ABC-type block copolymers	20
Tunable magnetic scattering and ferroelectric switching at the LaAlO3	20
Density functional theory study ofNO−H	20
Investigation of the structure-transport correlation in metal phthalocyanine thin films	20
Insensitivity of nucleation rate to order-disorder interfaces in reversible thermoelastic martensitic transformations	20
Room-temperature ferromagnetism in two-dimensional CrBr3	20
Temperature-induced structural and electronic phase transitions in λ -phase T	19
Disentangling transport mechanisms in a correlated oxide by photoinduced charge injection	19
Lateral solid phase epitaxy of yttrium iron garnet	19
van der Waals epitaxy and defect-charge manipulation of InSb islands on graphene-covered SiC(0001)	19
Thermodynamic stability of β -phases in Zr-Nb alloys	19
Short-to-medium range structure and glass-forming ability in metallic glasses	19
Structural, electronic, and magnetic properties of CrTe2	19
Low lattice thermal conductivity in Zintl phases Na2AuBi	18
Local laser-induced solid-phase recrystallization of phosphorus-implanted Si/SiGe heterostructures for contacts below 4.2 K	18
Origin and quantification of the ultimate carrier concentration limits in In2	18
Stabilization of ferroelectric Hf0.5Zr	18
Epitaxial HoN thin films: An investigation of the structural, electronic, and magnetic properties	18
Advanced single-crystal layered Ni-rich cathode materials for next-generation high-energy-density and long-life Li-ion batteries	18
Persistent opto-ferroelectric responses in molecular ferroelectrics	18
Impacts of substrate conditions and post-annealing on monolayer iron-based superconductors	18
Characterization of single in situ prepared interfaces composed of niobium and a selectively grown ( Bi	18
Band-gap engineering of rutile-structured SnO2−	18
Polar discontinuity governs surface segregation and interface termination: A case study of LaIn	18
Intrinsic spin Hall effect in topological semimetals with single Dirac nodal ring	18
Molecular beam epitaxy of superconducting FeSex	18
Chemomechanics in alloy phase stability	18
Determination of spin Hall angle in the Weyl ferromagnet Co2MnGa	18
Emergence of cubic ordered full-plane persistent spin textures in lead-free materials	17
Spin-lattice coupling in magnetocaloric Gd5	17
Structure-property relationships and mobility optimization in sputtered La-doped BaSn	17
Two-dimensional intrinsic ferrovalley Janus 2H-VSeS monolayer with high Curie temperature and robust valley polarization	17
Peierls-like distortion drives anion ordering in rutile TiOF	17
Coarsening of solidβ-Sn particles in liquid Pb-Sn alloys: Reinterpretation of experimental data in the framework of trans-interface-diffusion-controlled coarsening	17
Annealing-induced evolution of boron-doped polycrystalline diamond	17
Highly tunable band inversion in AB2X	17
Low-temperature paramagnetic phase reentrance in praseodymium-doped manganites	17
Epitaxial growth, structural and magnetic characterization of thulium thin films	17
Birefringence induced by antiferroelectric switching in transparent polycrystalline PbZr	17
Dielectric effects, crystal field, and shape anisotropy tuning of the exciton fine structure of halide perovskite nanocrystals	16
Microstructural analysis and electro-optic properties of thick epitaxial BaTiO3	16
Fragile altermagnetism and orbital disorder in Mott insulator LaTiO3	16
Ferroelectricity in oxygen-terminated two-dimensional carbides of lanthanide elements	16
Tunable Gilbert damping and magnetization in B-rich Fe1−	16
Understanding the fundamental driver of semiconductor radiation tolerance with experiment and theory	16
Magnetic properties of CoFeB films grown on a single-layer graphene underlayer	16
Thin film growth of phase-separating phthalocyanine-fullerene blends: A combined experimental and computational study	16
Synthesis and magnetic properties of the Shastry-Sutherland family R2	16
Enhanced diffusion and universal Rouse-like scaling of an active polymer in poor solvent	16
Antiphase boundary migration as a diffusion mechanism in a P3 sodium layered oxide	16
Phase coexistence and negative thermal expansion in the triple perovskite iridate Ba3	16
Valence study of Li(Ni0.5	16
Highly anisotropic magnetism in the vanadium-based kagome metal TbV6	16
Complex fermiology and electronic structure of antiferromagnet EuSnP	16
Band gaps of halide perovskites from a Wannier-localized optimally tuned screened range-separated hybrid functional	16
Tuning the flat bands of the kagome metal CoSn with Fe, In, or Ni doping	16
Unit-cell-thick domain in free-standing quasi-two-dimensional ferroelectric material	16
Charge density wave and superconductivity in the kagome metal CsV3	16
Relationship between molecular structure and corrugations in self-assembled polypeptoid nanosheets revealed by cryogenic electron microscopy	16
Engineering underdoped CuO2 nanoribbons in nm-thick 16

Large fieldlike torque in amorphous Ru2Sn3	16
Control of band structure of FeSe single crystals via biaxial strain	16
Distinctive characteristics of exciton-phonon interactions in optically driven MoS2	15
New Gd-based magnetic compoundGdPt2B	15
Localization of edge states at triangular defects in periodic MoS	15
Anisotropic magnetotransport properties coupled with spiral spin modulation in a magnetic semimetal EuZnGe	15
Bulk electronic structure of lanthanum hexaboride ( LaB6	15
Probing intrinsic magnetization dynamics of the Y3	15
High-resolution diffraction reveals magnetoelastic coupling and coherent phase separation in tetragonal CuMnAs	15
Ground-state structures, electronic structure, transport properties and optical properties of Ca-based anti-Ruddlesden-Popper phase oxide perovskites	15
Relation between crystal structure and optical properties in the correlated blue pigment YIn	15
Epitaxial strain-tuned oxygen vacancy formation, reduction behavior, and electronic structure of perovskite SrIr	15
Clamping effect on temperature-induced valence transition in epitaxial EuPd2<	15
α−β phase transition of zirconium predicted by on-the-fly machine-learned	15
Cr-Cr distance and magnetism in the phase diagram of triangular lattice antiferromagnets: A systematic comparative study	15
Vacancy localization effects on MX2 transition-metal d	15
Resonant transition metal Ti or Ta doping in high mobility transparent conducting CdO: The effects of doping concentration	15
Dilution of the magnetic lattice in the Kitaev candidate α−RuCl	15
Electronegative metal dopants improve switching variability in Al2<	15
Effective reduction of PdCoO2 thin films via hydrogenation and sign tunable	15
Influence of crystalline defects on magnetic nanodomains in a rare-earth-free magnetocrystalline anisotropic alloy	15
Defect control in the Heisenberg-Kitaev candidate material NaRuO2	15
Ultrafast phase transitions in polyamorphic materials triggered by swift heavy ion impacts	14
Energy-efficient spin injector into semiconductors driven by elastic waves	14
Growing borophene on metal substrates: A theoretical study of the role of oxygen on Al(111)	14
Fermiology of a topological line-nodal compound CaSb2	14
Nodal line induced large transverse thermoelectric response in the D0	14
Enhanced mobility of ternary InGaAs quantum wells through digital alloying	14
Reaction kinetics of the thermal decomposition of MAPbI3 thin films	14
Using ferroelastic variant switching to tune ferromagnetic properties of 1T	14
Quasi-isotropic orbital magnetoresistance in lightly doped SrTiO3<	14
Imaging CdCl2 defect passivation and formation in poly	14
Revealing defect-induced spin disorder in nanocrystalline Ni	14
Magnetic Weyl and quadratic nodal lines in inverse-Heusler-based fully compensated ferrimagnetic half-metals	14
Transient electron scavengers modulate carrier density at a polar/nonpolar perovskite oxide heterojunction	14
Elastic interactions of plastic events in strained amorphous solids before yield	14
Vacancy-mediated transport and segregation tendencies of solutes in fcc nickel under diffusional creep: A density functional theory study	14
Early-stage growth of GeTe on Si(111)-Sb	14
Strong correlation between ionic bonding strength and superconductivity in compressed hydrides	14
Electronic and optical properties of Janus-like hexagonal monolayer materials of group IV-VI	14
Magnetic properties of van der Waals layered single crystals DyOBr and SmOCl	14
Helical microstructures in molluscan biomineralization are a biological example of close packed helices that may form from a colloidal liquid crystal precursor in a twist–bend nematic phase	14
Atomic-scale characterization of single and double layers of InAs and InAlAs Stranski-Krastanov quantum dots	14
Enhancement of excitonic and defect-related luminescence in neutron transmutation doped β−	14
Interplay between dislocation type and local structure in dislocation-twin boundary reactions in Cu	14
Interaction between dislocation and vacancies in magnesium oxide: Insights from atomistic simulations and elasticity theory	14
Insight into the mechanism of bidirectional magnetoelectric effects unveil cycloidal/uncompensated hybrid antiferromagnetic multiferroics	14
Phase transition pathway of hybrid halide perovskites under compression: Insights from first-principles calculations	14
Two-dimensional 2γ−In2	13
Understanding magnetic phase coexistence in Ru2Mn<	13
Optical and excitonic properties of transition metal oxide perovskites by the Bethe-Salpeter equation	13
Epitaxial growth, magnetoresistance, and electronic band structure of GdSb magnetic semimetal films	13
Symmetry-driven large tunneling magnetoresistance in SrRuO3 magnetic tunnel	13
Proximate Tomonaga-Luttinger liquid in a spin- 1/2 ferromag	13
Lead-free room-temperature ferroelectric thermal conductivity switch using anisotropies in thermal conductivities	13
Tetragonal phases in Fe-Ga alloys: A quantitative study	13
Boundary-induced phase in epitaxial iron layers	13
Amplitude expansion of the phase-field crystal model for complex crystal structures	13
Room-temperature persistent photoconductivity of KTaO3	13
Topological Hall effect induced by chiral fluctuations in ErMn6	13
First-principles study of strain behavior in iron-based fluorides of tungsten bronze type as cathode materials for alkali-ion batteries	13
Subjugating extensive magnetostructural temperature window and giant magnetocaloric effect in B-doped (<	13
Canted antiferromagnetism in a van der Waals metallic material TaNi2	13
Effect of (001) and (111) epitaxial strain on Pnma perovskite oxides	13
Absence of itinerant ferromagnetism in a cobalt-based oxypnictide	13
Magnetic ordering of the Mo3O	13
Magnetic phase dependency of the thermal conductivity of FeRh from thermoreflectance experiments and numerical simulations	13
Excitonic trion population in two-dimensional halide perovskites	13
Entangled origins of the nonmagnetic states of U and Fe atoms in hydrogenated UFeGe	13
Ferroelectricity in strained Hf2CF2	13
Understanding the behavior of exchange bias and coercive fields and connections with anisotropic interfaces in Co<	13
Origin of the difference in spin-dependent transport properties between half-metallic C	13
Magnetostriction of AlFe213
Highly interpretable machine learning framework for prediction of mechanical properties of nickel based superalloys	13
Predicting and following T1 events in dry foams from geometric features	13
Bayesian estimations of orientation distribution functions from small-angle scattering enable direct prediction of mechanical stress in anisotropic materials	13
Magnetic excitation linking quasi-one-dimensional Chevrel-type selenide and arsenide superconductors	13
Perfect in-plane CrI3 spin-valve driven by photogalvanic effect	13
Continuous structural phase transition and antiferromagnetic order in ilmenite-type NiVO3	13
Mechanical regularization	13
Optically resolved exchange splittings in the doped van der Waals ferromagnet CrBr3	13
Identifying crystal structures beyond known prototypes from x-ray powder diffraction spectra	12
Intrinsic instability to martensite phases in ferromagnetic shape memory alloy Ni2	12
Assessing grain boundary variability through phase field crystal simulations	12
Surface state mediated ferromagnetism in Mn0.14	12
Insulating moiré homobilayers lack a threefold symmetric second-harmonic generation	12
Fe and Cr co-intercalation in 2H-NbS	12
Dynamic glass transition dramatically accelerates crack propagation in rubberlike solids	12
Learning from metastable symmetric-tilt grain boundaries using physics-based descriptors	12
Thermal cycling induced alteration of the stacking order and spin-flip in the room temperature van der Waals magnet	12
Cd implantation in α−MoO3<	12
Acceptor and donor impurity levels in hexagonal-diamond silicon	12
Thin film synthesis, structural analysis, and magnetic properties of novel ternary transition metal nitride MnCoN	12
First-principles study of the electronic, magnetic, and crystal structure of perovskite molybdates	12
Impact of nitrogen doping on the band structure and the charge carrier scattering in monolayer graphene	12