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Journal Articles

The quantum origin of magnetic coupling in molecular crystals for spintronics

James Broadhurst, Giuseppe Mallia, Nicholas Harrison

J. Chem. Phys. 162, 244708 (2025)

https://doi.org/10.1063/5.0273115

Published: June 2025

View articletitled, The quantum origin of magnetic coupling in molecular crystals for spintronics

Journal Articles

Density-matrix embedding based multi-reference perturbation theory approach to single-ion magnets

Zhebin Guan, Hong Jiang

J. Chem. Phys. 162, 224111 (2025)

https://doi.org/10.1063/5.0269968

Published: June 2025

View articletitled, Density-matrix embedding based multi-reference perturbation theory approach to single-ion magnets

Journal Articles

Unusual zero field cooled exchange bias and related mechanism in YBaCuFeO₅–Ni_0.3Zn_0.7Fe₂O₄ composites

A. K. Sahoo, Anupama Pati, Sujata Kumari Ray, Payala Sahoo, Vishal Kumar, Sanjay Singh, S. Dash

J. Chem. Phys. 162, 114702 (2025)

https://doi.org/10.1063/5.0249484

Published: March 2025

View articletitled, Unusual zero field cooled exchange bias and related mechanism in YBaCuFeO5–Ni0.3Zn0.7Fe2O4 composites

Journal Articles

Structural refinement and magnetic tuning in cobalt-substituted SrFe₁₂O₁₉ hexaferrite

Moatoshi, C. Borgohain, S. D. Kaushik, J. P. Borah

J. Chem. Phys. 162, 054719 (2025)

https://doi.org/10.1063/5.0244691

Published: February 2025

View articletitled, Structural refinement and magnetic tuning in cobalt-substituted SrFe12O19 hexaferrite

Journal Articles

Gearing of nitrate ions in ammonium nitrate

Na Du, Xintian Wang, Yu Ying Zhu, Chanreingam Long, Peng Ren, Fei Yen

J. Chem. Phys. 162, 054506 (2025)

https://doi.org/10.1063/5.0250079

Published: February 2025

View articletitled, Gearing of nitrate ions in ammonium nitrate

Journal Articles

Considerable spin asymmetry of deep valence states induced by partial neutralization of charged SrTiO₃(011) surfaces

Larisa E. Borcan, Alexandru-Cristi Iancu, Dana G. Popescu, Cristian M. Teodorescu

J. Chem. Phys. 162, 054707 (2025)

https://doi.org/10.1063/5.0243885

Published: February 2025

View articletitled, Considerable spin asymmetry of deep valence states induced by partial neutralization of charged SrTiO3(011) surfaces

Journal Articles

Desertion of anomalous magnetic transition and emergence of metallic state in Cu doped Eu₂Ru₂O₇ pyrochlore

Soma Chatterjee, I. Das

J. Chem. Phys. 161, 244706 (2024)

https://doi.org/10.1063/5.0238254

Published: December 2024

View articletitled, Desertion of anomalous magnetic transition and emergence of metallic state in Cu doped Eu2Ru2O7 pyrochlore

Journal Articles

Magnetic ordering and half-metallicity in hydrogenated graphene-hBN nanoribbons

Maja Varga Pajtler, I. Kovač, M. Topalović, I. Lukačević

J. Chem. Phys. 161, 234701 (2024)

https://doi.org/10.1063/5.0238516

Published: December 2024

View articletitled, Magnetic ordering and half-metallicity in hydrogenated graphene-hBN nanoribbons

Journal Articles

Infinite ground-state degeneracy of a two-dimensional athermal lattice-gas

Mauro Sellitto

J. Chem. Phys. 161, 224102 (2024)

https://doi.org/10.1063/5.0244700

Published: December 2024

View articletitled, Infinite ground-state degeneracy of a two-dimensional athermal lattice-gas

Journal Articles

Surface weak ferromagnet coupling induced giant room-temperature spontaneous exchange bias in antiferromagnet Fe₃BO₆ polycrystals

Lifeng Wang, Ling Cai, Xiong He, Fanli Yang, Jie Chen, Lizhi Yi, Min Liu, Yunli Xu, Zhengcai Xia, Liqing Pan

J. Chem. Phys. 161, 154706 (2024)

https://doi.org/10.1063/5.0225163

Published: October 2024

View articletitled, Surface weak ferromagnet coupling induced giant room-temperature spontaneous exchange bias in antiferromagnet Fe3BO6 polycrystals

Journal Articles

Effect of Zn-substitution on magnetic structure of cobalt ferrite nanoparticles

Sonja Jovanović, Nader Yaacoub, Sawssen Slimani, Marjeta Maček Kržmanc, Marija Vukomanović, Matjaž Spreitzer, Davide Peddis, Alexander Omelyanchik

J. Chem. Phys. 161, 124712 (2024)

https://doi.org/10.1063/5.0226884

Published: September 2024

View articletitled, Effect of Zn-substitution on magnetic structure of cobalt ferrite nanoparticles

Journal Articles

Ligand field exciton annihilation in bulk CrCl₃

Samanvitha Sridhar, Ario Khansari, Shaun O’Donnell, Alexandra T. Barth, Evgeny O. Danilov, Felix N. Castellano, Paul A. Maggard, Daniel B. Dougherty

J. Chem. Phys. 161, 114706 (2024)

https://doi.org/10.1063/5.0223772

Published: September 2024

View articletitled, Ligand field exciton annihilation in bulk CrCl3

Journal Articles

A prediction of high temperature magnetic coupling in transition metal phthalocyanines

James Broadhurst, Giuseppe Mallia, Nicholas Harrison

J. Chem. Phys. 161, 114703 (2024)

https://doi.org/10.1063/5.0218997

Published: September 2024

View articletitled, A prediction of high temperature magnetic coupling in transition metal phthalocyanines

Journal Articles

Physical origin of the anisotropic exchange tensor close to the first-order spin–orbit coupling regime and impact of the electric field on its magnitude

Flaurent Heully-Alary, Barthélémy Pradines, Nicolas Suaud, Nathalie Guihéry

J. Chem. Phys. 161, 054310 (2024)

https://doi.org/10.1063/5.0218707

Published: August 2024

View articletitled, Physical origin of the anisotropic exchange tensor close to the first-order spin–orbit coupling regime and impact of the electric field on its magnitude

Journal Articles

Metal-support spin orders: Crucial effect on electrocatalytic oxygen reduction

Yi-jie Chen, Jun Wen, Zhi-rui Luo, Fu-Li Sun, Wen-xian Chen, Gui-lin Zhuang

J. Chem. Phys. 160, 224702 (2024)

https://doi.org/10.1063/5.0207891

Published: June 2024

View articletitled, Metal-support spin orders: Crucial effect on electrocatalytic oxygen reduction

Journal Articles

Role of Griffiths phase on magnetocaloric properties and critical behavior of half-doped manganites [La_0.5Sr_0.5−xCa_xMnO₃(x = 0, 0.25, 0.5)]

Sibasish Mandal, Sipun Mohanty, Sujay Chakravarty, Samrat Mukherjee

J. Chem. Phys. 160, 214201 (2024)

https://doi.org/10.1063/5.0204312

Published: June 2024

View articletitled, Role of Griffiths phase on magnetocaloric properties and critical behavior of half-doped manganites [La0.5Sr0.5−xCaxMnO3(x = 0, 0.25, 0.5)]

Journal Articles

Magnetically driven molecular orientational ordering in plastic crystals: The case of d-camphor

Miao Miao Zhao (赵苗苗), Na Du (杜娜), Yu Ying Zhu (朱语盈), Fei Yen (晏飛翔)

J. Chem. Phys. 160, 154506 (2024)

https://doi.org/10.1063/5.0198042

Published: April 2024

View articletitled, Magnetically driven molecular orientational ordering in plastic crystals: The case of d-camphor

Journal Articles

Symmetry breaking and self-interaction correction in the chromium atom and dimer

Rohan Maniar, Kushantha P. K. Withanage, Chandra Shahi, Aaron D. Kaplan, John P. Perdew, Mark R. Pederson

J. Chem. Phys. 160, 144301 (2024)

https://doi.org/10.1063/5.0180863

Published: April 2024

View articletitled, Symmetry breaking and self-interaction correction in the chromium atom and dimer

Journal Articles

Foreword to the Special Issue Chiral Induced Spin Selectivity

Ron Naaman, Joseph E. Subotnik, David H. Waldeck

J. Chem. Phys. 160, 096101 (2024)

https://doi.org/10.1063/5.0202379

Published: March 2024

View articletitled, Foreword to the Special Issue Chiral Induced Spin Selectivity

Journal Articles

Zero-field splitting parameters within exact two-component theory and modern density functional theory using seminumerical integration

Florian Bruder, Yannick J. Franzke, Christof Holzer, Florian Weigend

J. Chem. Phys. 159, 194117 (2023)

https://doi.org/10.1063/5.0175758

Published: November 2023

View articletitled, Zero-field splitting parameters within exact two-component theory and modern density functional theory using seminumerical integration

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The quantum origin of magnetic coupling in molecular crystals for spintronics

Density-matrix embedding based multi-reference perturbation theory approach to single-ion magnets

Unusual zero field cooled exchange bias and related mechanism in YBaCuFeO₅–Ni_0.3Zn_0.7Fe₂O₄ composites

Structural refinement and magnetic tuning in cobalt-substituted SrFe₁₂O₁₉ hexaferrite

Gearing of nitrate ions in ammonium nitrate

Considerable spin asymmetry of deep valence states induced by partial neutralization of charged SrTiO₃(011) surfaces

Desertion of anomalous magnetic transition and emergence of metallic state in Cu doped Eu₂Ru₂O₇ pyrochlore

Magnetic ordering and half-metallicity in hydrogenated graphene-hBN nanoribbons

Infinite ground-state degeneracy of a two-dimensional athermal lattice-gas

Surface weak ferromagnet coupling induced giant room-temperature spontaneous exchange bias in antiferromagnet Fe₃BO₆ polycrystals

Effect of Zn-substitution on magnetic structure of cobalt ferrite nanoparticles

Ligand field exciton annihilation in bulk CrCl₃

A prediction of high temperature magnetic coupling in transition metal phthalocyanines

Physical origin of the anisotropic exchange tensor close to the first-order spin–orbit coupling regime and impact of the electric field on its magnitude

Metal-support spin orders: Crucial effect on electrocatalytic oxygen reduction

Role of Griffiths phase on magnetocaloric properties and critical behavior of half-doped manganites [La_0.5Sr_0.5−xCa_xMnO₃(x = 0, 0.25, 0.5)]

Magnetically driven molecular orientational ordering in plastic crystals: The case of d-camphor

Symmetry breaking and self-interaction correction in the chromium atom and dimer

Foreword to the Special Issue Chiral Induced Spin Selectivity

Zero-field splitting parameters within exact two-component theory and modern density functional theory using seminumerical integration

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