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Exchange Coupling Inversion in a High-Spin Organic Triradical Molecule

Nano letters, 2016-03, Vol.16 (3), p.2066-2071

2016

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Magnetic coupling and spin ordering in bisdithiazolyl, thiaselenazolyl, and bisdiselenazolyl molecular materials

Dalton transactions : an international journal of inorganic chemistry, 2022-08, Vol.51 (34), p.1332-1345

2022

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Understanding trends in conductivity in four isostructural multifunctional crystals of Se substituted bis-dithiazolyl radicals

Journal of materials chemistry. C, Materials for optical and electronic devices, 2024-01, Vol.12 (2), p.468-48

2024

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Comment on “About the calculation of exchange coupling constants using density-functional theory: The role of the self-interaction error” [J. Chem. Phys. 123, 164110 (2005)]

The Journal of chemical physics, 2006-03, Vol.124 (10), p.107101-107101-3

2006

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Disruption of the Chemical Environment and Electronic Structure in p-Type Cu2O Films by Alkaline Doping

Journal of physical chemistry. C, 2012-06, Vol.116 (25), p.13524-13535

2012

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Erratum: Highly Adiabatic Time-Optimal Quantum Driving at Low Energy Cost [Phys. Rev. Lett. 129, 180402 (2022)]

Physical review letters, 2023-02, Vol.130 (8), p.089901-089901, Article 089901

2023

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Unconventional Biradical Character of Titanium Enolates

Journal of the American Chemical Society, 2008-03, Vol.130 (11), p.3242-3243

2008

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Remarks on the Proper Use of the Broken Symmetry Approach to Magnetic Coupling

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 1997-10, Vol.101 (42), p.7860-7866

1997

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Extent and limitations of density-functional theory in describing magnetic systems

Physical review. B, Condensed matter and materials physics, 2004, Vol.70 (13), p.132414.1-132414.4, Article 132414

2004

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Charge Density Analysis of Triplet and Broken Symmetry States Relevant to Magnetic Coupling in Systems with Localized Spin Moments

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2001-04, Vol.105 (14), p.3570-3577

2001

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Disruption of the Chemical Environment and Electronic Structure in p-Type Cu 2 O Films by Alkaline Doping

Journal of physical chemistry. C, 2012-06, Vol.116 (25), p.13524-13535

2012

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Magnitude of the First and Second Neighbour Magnetic Interactions in the Spin Chain Compound Li2CuO2

International journal of molecular sciences, 2000-09, Vol.1 (3), p.28-38

2000

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The structural relaxation of the α-Al2O3(0001): an investigation of potential errors

Chemical physics letters, 2001-06, Vol.341 (5-6), p.412-418

2001

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Ab initio cluster model approach to the chemisorption of NH3 on Pt(111)

Surface science, 1999-06, Vol.430 (1-3), p.18-28

1999

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Accurate Prediction of Large Antiferromagnetic Interactions in High- T c HgBa 2 Ca n − 1 Cu n O 2 n + 2 + δ ( n = 2 , 3 ) Superconductor Parent Compounds

Physical review letters, 2000-02, Vol.84 (7), p.1579-1582

2000

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Derivation of spin Hamiltonians from the exact Hamiltonian: Application to systems with two unpaired electrons per magnetic site

Physical review. B, Condensed matter, 2002-10, Vol.66 (13), Article 134430

2002

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Proper ferroelectric transition in the multiferroic YMnO 3

Acta crystallographica. Section A, Foundations of crystallography, 2006-08, Vol.62 (a1), p.s121-s121

2006

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Accurate prediction of large antiferromagnetic interactions in high- T(c) HgBa2Ca(n-1)Cu(n)O(2n+2+delta) ( n = 2,3) superconductor parent compounds

Physical review letters, 2000-02, Vol.84 (7), p.1579-1582

2000

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Absence of collective effects in Heisenberg systems with localized magnetic moments

Physical review. B, Condensed matter, 1997-09, Vol.56 (9), p.5069-5072

1997

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Ab initio study of the magnetic interactions in the spin-ladder compound SrCu 2 O 3

Physical review. B, Condensed matter, 1999-08, Vol.60 (5), p.3457-3464

1999

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Magnetic coupling in the weak ferromagnet CuF 2

Physical review. B, Condensed matter, 1999-01, Vol.59 (2), p.1016-1023

1999

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Prevalence, Indirect Costs, and Risk Factors for Work Disability in Patients with Crohn’s Disease at a Tertiary Care Center in Rio de Janeiro

Digestive diseases and sciences, 2021-09, Vol.66 (9), p.2925-2934

2021

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How does thickness affect magnetic coupling in Ti-based MXenes

Physical chemistry chemical physics : PCCP, 2023-07, Vol.25 (26), p.17116-17127

2023

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Redox-Induced Gating of the Exchange Interactions in a Single Organic Diradical

ACS nano, 2017-06, Vol.11 (6), p.5879-5883

2017

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Immunogenicity of a Bivalent Non-Purified Recombinant Vaccine against Botulism in Cattle

Toxins, 2018-09, Vol.10 (10), p.381

2018

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Exchange Coupling Inversion in a High-Spin Organic Triradical Molecule

Magnetic coupling and spin ordering in bisdithiazolyl, thiaselenazolyl, and bisdiselenazolyl molecular materials

Understanding trends in conductivity in four isostructural multifunctional crystals of Se substituted bis-dithiazolyl radicals

Comment on “About the calculation of exchange coupling constants using density-functional theory: The role of the self-interaction error” [J. Chem. Phys. 123, 164110 (2005)]

Disruption of the Chemical Environment and Electronic Structure in p-Type Cu2O Films by Alkaline Doping

Erratum: Highly Adiabatic Time-Optimal Quantum Driving at Low Energy Cost [Phys. Rev. Lett. 129, 180402 (2022)]

Unconventional Biradical Character of Titanium Enolates

Remarks on the Proper Use of the Broken Symmetry Approach to Magnetic Coupling

Extent and limitations of density-functional theory in describing magnetic systems

Charge Density Analysis of Triplet and Broken Symmetry States Relevant to Magnetic Coupling in Systems with Localized Spin Moments

Disruption of the Chemical Environment and Electronic Structure in p-Type Cu 2 O Films by Alkaline Doping

Magnitude of the First and Second Neighbour Magnetic Interactions in the Spin Chain Compound Li2CuO2

The structural relaxation of the α-Al2O3(0001): an investigation of potential errors

Ab initio cluster model approach to the chemisorption of NH3 on Pt(111)

Accurate Prediction of Large Antiferromagnetic Interactions in High- T c HgBa 2 Ca n − 1 Cu n O 2 n + 2 + δ ( n = 2 , 3 ) Superconductor Parent Compounds

Derivation of spin Hamiltonians from the exact Hamiltonian: Application to systems with two unpaired electrons per magnetic site

Proper ferroelectric transition in the multiferroic YMnO 3

Accurate prediction of large antiferromagnetic interactions in high- T(c) HgBa2Ca(n-1)Cu(n)O(2n+2+delta) ( n = 2,3) superconductor parent compounds

Absence of collective effects in Heisenberg systems with localized magnetic moments

Ab initio study of the magnetic interactions in the spin-ladder compound SrCu 2 O 3

Magnetic coupling in the weak ferromagnet CuF 2

Prevalence, Indirect Costs, and Risk Factors for Work Disability in Patients with Crohn’s Disease at a Tertiary Care Center in Rio de Janeiro

How does thickness affect magnetic coupling in Ti-based MXenes

Redox-Induced Gating of the Exchange Interactions in a Single Organic Diradical

Immunogenicity of a Bivalent Non-Purified Recombinant Vaccine against Botulism in Cattle

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