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Key Role of Deep Orbitals in the dx2-y2-d3z2-r2 Gap in Tetragonal Complexes and 10Dq

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2021-03, Vol.125 (11), p.2284-2293

2021

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Key Role of Deep Orbitals in the d x 2 - y 2 -d 3 z 2 - r 2 Gap in Tetragonal Complexes and 10 Dq

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2021-03, Vol.125 (11), p.2284-2293

2021

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Explaining the optical spectrum of CrF2 and CuF2 model materials: role of the tetragonal to monoclinic instability

Physical chemistry chemical physics : PCCP, 2019, Vol.21 (22), p.11714-11723

2019

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Local structure and excitations in systems with CuF64− units: lack of Jahn–Teller effect in the low symmetry compound Na2CuF4

Physical chemistry chemical physics : PCCP, 2020-01, Vol.22 (15), p.7875-7887

2020

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Explaining the optical spectrum of CrF 2 and CuF 2 model materials: role of the tetragonal to monoclinic instability

Physical chemistry chemical physics : PCCP, 2019-06, Vol.21 (22), p.11714-11723

2019

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Changing the Usual Interpretation of the Structure and Ground State of Cu2+-Layered Perovskites

Journal of physical chemistry. C, 2018-03, Vol.122 (9), p.5071-5082

2018

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Local structure and excitations in systems with CuF 6 4- units: lack of Jahn-Teller effect in the low symmetry compound Na 2 CuF 4

Physical chemistry chemical physics : PCCP, 2020-04, Vol.22 (15), p.7875-7887

2020

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Spectrochemical Series and the Dependence of Racah and 10Dq Parameters on the Metal−Ligand Distance: Microscopic Origin

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2011-03, Vol.115 (8), p.1423-1432

2011

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Mesorectal failure after chemoradiotherapy for squamous cell carcinoma of the anus: is sphincter-saving surgery reasonable?

Techniques in coloproctology, 2023-05, Vol.27 (5), p.379-388

2023

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Colour due to Cr3+ ions in oxides: a study of the model system MgO:Cr3

Journal of physics. Condensed matter, 2013-05, Vol.25 (17), p.175501-175501

2013

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Spectrochemical series and the dependence of Racah and 10 Dq parameters on the metal-ligand distance: microscopic origin

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2011-03, Vol.115 (8), p.1423-1432

2011

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Stability and Polaronic Motion of Self-Trapped Holes in Silver Halides: Insight through DFT+U Calculations

Journal of physical chemistry. C, 2016-04, Vol.120 (16), p.8509-8524

2016

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Benchmark study for the application of density functional theory to the prediction of octahedral tilting in perovskites

Physical review. B, Condensed matter and materials physics, 2012-10, Vol.86 (14), Article 144107

2012

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Sharp Lines Due to Cr3+ and Mn2+ Impurities in Insulators: Going Beyond the Usual Tanabe–Sugano Approach

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2014-03, Vol.118 (12), p.2377-2384

2014

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Cr3+-Doped Fluorides and Oxides: Role of Internal Fields and Limitations of the Tanabe–Sugano Approach

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2011-11, Vol.115 (46), p.13399-13406

2011

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Microscopic insight into properties and electronic instabilities of impurities in cubic and lower symmetry insulators: the influence of pressure

Journal of physics. Condensed matter, 2006-05, Vol.18 (17), p.R315-R360

2006

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Cu2+ in Layered Compounds: Origin of the Compressed Geometry in the Model System K2ZnF4:Cu2

Inorganic chemistry, 2013-06, Vol.52 (12), p.6923-6933

2013

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Origin of Small Barriers in Jahn–Teller Systems: Quantifying the Role of 3d–4s Hybridization in the Model System NaCl:Ni

Inorganic chemistry, 2013-08, Vol.52 (16), p.9338-9348

2013

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new Capsicum baccatum accession shows tolerance to wild‐type and resistance‐breaking isolates of Tomato spotted wilt virus

Annals of applied biology, 2015-11, Vol.167 (3), p.343-353

2015

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Cr3+ in layered perovskites: do the electron paramagnetic resonance parameters only depend on the impurity–ligand distances?

Journal of physics. Condensed matter, 2010-04, Vol.22 (15), p.155502-155502

2010

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Tunneling splitting of Jahn-Teller ions in oxides

Physical review letters, 2010-01, Vol.104 (3), p.035901-035901

2010

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Transition Metal Complexes Coupled to Vacancies in Oxides: Origin of Different Properties of Cr3+ in MgO Bounded to a ⟨100⟩ or ⟨110⟩ Mg2+ Vacancy

The journal of physical chemistry. A, Molecules, spectroscopy, kinetics, environment, & general theory, 2013-11, Vol.117 (47), p.12642-12647

2013

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Cucumber vein yellowing virus isolate-specific expression of symptoms and viral RNA accumulation in susceptible and resistant cucumber cultivars

Crop protection, 2013-01, Vol.43, p.141-145

2013

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HAZELNUT CULTIVARS AFFECTED BY APMV

Acta horticulturae, 2014 (1052), p.289-291

2014

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Explaining the optical spectrum of CrF and CuF model materials: role of the tetragonal to monoclinic instability

Physical chemistry chemical physics : PCCP, 2019-06, Vol.21 (22), p.11714-11723

2019

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Key Role of Deep Orbitals in the dx2-y2-d3z2-r2 Gap in Tetragonal Complexes and 10Dq

Key Role of Deep Orbitals in the d x 2 - y 2 -d 3 z 2 - r 2 Gap in Tetragonal Complexes and 10 Dq

Explaining the optical spectrum of CrF2 and CuF2 model materials: role of the tetragonal to monoclinic instability

Local structure and excitations in systems with CuF64− units: lack of Jahn–Teller effect in the low symmetry compound Na2CuF4

Explaining the optical spectrum of CrF 2 and CuF 2 model materials: role of the tetragonal to monoclinic instability

Changing the Usual Interpretation of the Structure and Ground State of Cu2+-Layered Perovskites

Local structure and excitations in systems with CuF 6 4- units: lack of Jahn-Teller effect in the low symmetry compound Na 2 CuF 4

Spectrochemical Series and the Dependence of Racah and 10Dq Parameters on the Metal−Ligand Distance: Microscopic Origin

Mesorectal failure after chemoradiotherapy for squamous cell carcinoma of the anus: is sphincter-saving surgery reasonable?

Colour due to Cr3+ ions in oxides: a study of the model system MgO:Cr3

Spectrochemical series and the dependence of Racah and 10 Dq parameters on the metal-ligand distance: microscopic origin

Stability and Polaronic Motion of Self-Trapped Holes in Silver Halides: Insight through DFT+U Calculations

Benchmark study for the application of density functional theory to the prediction of octahedral tilting in perovskites

Sharp Lines Due to Cr3+ and Mn2+ Impurities in Insulators: Going Beyond the Usual Tanabe–Sugano Approach

Cr3+-Doped Fluorides and Oxides: Role of Internal Fields and Limitations of the Tanabe–Sugano Approach

Microscopic insight into properties and electronic instabilities of impurities in cubic and lower symmetry insulators: the influence of pressure

Cu2+ in Layered Compounds: Origin of the Compressed Geometry in the Model System K2ZnF4:Cu2

Origin of Small Barriers in Jahn–Teller Systems: Quantifying the Role of 3d–4s Hybridization in the Model System NaCl:Ni

new Capsicum baccatum accession shows tolerance to wild‐type and resistance‐breaking isolates of Tomato spotted wilt virus

Cr3+ in layered perovskites: do the electron paramagnetic resonance parameters only depend on the impurity–ligand distances?

Tunneling splitting of Jahn-Teller ions in oxides

Transition Metal Complexes Coupled to Vacancies in Oxides: Origin of Different Properties of Cr3+ in MgO Bounded to a ⟨100⟩ or ⟨110⟩ Mg2+ Vacancy

Cucumber vein yellowing virus isolate-specific expression of symptoms and viral RNA accumulation in susceptible and resistant cucumber cultivars

HAZELNUT CULTIVARS AFFECTED BY APMV

Explaining the optical spectrum of CrF and CuF model materials: role of the tetragonal to monoclinic instability

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