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Alliacane-Type Secondary Metabolites from Submerged Cultures of the Basidiomycete Clitocybe nebularis

Journal of natural products (Washington, D.C.), 2022-10, Vol.85 (10), p.2363-2371

2022

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Trapping the Transition State in a [2,3]-Sigmatropic Rearrangement by Applying Pressure

ACS omega, 2022-12, Vol.7 (49), p.45208-45214

2022

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On the Interplay Between Force, Temperature, and Electric Fields in the Rupture Process of Mechanophores

Chemphyschem, 2024-07, p.e202400648

2024

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Synthesis and crystal structure of 2-(anthracen-9-yl)-1-(tert-butyldimethylsilyl)-3,6-dihydro-1λ4,2λ4-azaborinine

Acta crystallographica. Section E, Crystallographic communications, 2023-11, Vol.79 (11), p.1012-1016

2023

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Complexation of Boron and Aluminum with a Bidentate Hydroxy-BN-naphthalene Ligand

Inorganics, 2023-07, Vol.11 (7), p.295

2023

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Emergent Properties in Chemistry ‐ Relating Molecular Properties to Bulk Behavior

Chemistry : a European journal, 2024-05, Vol.30 (25), p.e202303868-n/a

2024

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Investigating the accuracy of density functional methods for molecules in electric fields

The Journal of chemical physics, 2023-09, Vol.159 (12)

2023

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JEDI: A versatile code for strain analysis of molecular and periodic systems under deformation

The Journal of chemical physics, 2024-04, Vol.160 (15)

2024

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Calculating high-pressure vibrational frequencies analytically with the extended hydrostatic compression force field approach

The Journal of chemical physics, 2024-02, Vol.160 (8)

2024

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An efficient implementation of the GOSTSHYP pressure model by applying shell-bounding Gaussian 1-electron-3-center integral screening

The Journal of chemical physics, 2022-11, Vol.157 (18), p.184802-184802

2022

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Multiscale Mechanochemical Modeling of Spiropyran–Merocyanine Isomerization in Linear PMMA Polymers

Macromolecules, 2023-11, Vol.56 (21), p.8438-8447

2023

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An in-silico NMR laboratory for nuclear magnetic shieldings computed via finite fields: Exploring nucleus-specific renormalizations of MP2 and MP3

The Journal of chemical physics, 2023-04, Vol.158 (16)

2023

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Can a Finite Chain of Hydrogen Cyanide Molecules Model a Crystal?

Chemphyschem, 2022-12, Vol.23 (23), p.e202200414-n/a

2022

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Computational high‐pressure chemistry: Ab initio simulations of atoms, molecules, and extended materials in the gigapascal regime

Wiley interdisciplinary reviews. Computational molecular science, 2024-03, Vol.14 (2), p.e1708-n/a

2024

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Boosting quantum yields and circularly polarized luminescence of penta- and hexahelicenes by doping with two BN-groups

Chemical science (Cambridge), 2024-01, Vol.15 (2), p.466-476

2024

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CREST—A program for the exploration of low-energy molecular chemical space

The Journal of chemical physics, 2024-03, Vol.160 (11)

2024

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Notizen aus der Chemie

Nachrichten aus der Chemie, 2024-06, Vol.72 (6), p.52-55

2024

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Nano-crystalline precursor formation, stability, and transformation to mullite-type visible-light photocatalysts

Journal of materials science, 2022-11, Vol.57 (41), p.19280-19299

2022

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Notizen aus der Chemie

Nachrichten aus der Chemie, 2024-04, Vol.72 (4), p.48-51

2024

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Notizen aus der Chemie

Nachrichten aus der Chemie, 2024-03, Vol.72 (3), p.40-43

2024

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Notizen aus der Chemie

Nachrichten aus der Chemie, 2024-02, Vol.72 (2), p.42-45

2024

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Synthesis and crystal structure of 2-(anthracen-9-yl)-1-( tert -butyldimethylsilyl)-3,6-dihydro-1λ 4 ,2λ 4 -azaborinine

Acta crystallographica. Section E, Crystallographic communications, 2023-11, Vol.79 (11), p.1012-1016

2023

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Synthesis and crystal structure of 2-(anthracen-9-yl)-1-(tert-butyl-dimethyl-sil-yl)-3,6-di-hydro-1λ4,2λ4-aza-borinine

Acta crystallographica. Section E, Crystallographic communications, 2023-11, Vol.79 (Pt 11), p.1012-1016

2023

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Notizen aus der Chemie

Nachrichten aus der Chemie, 2024-01, Vol.72 (1), p.46-49

2024

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BN-Substitution in Dithienylpyrenes Prevents Excimer Formation in Solution and in the Solid State

Journal of physical chemistry. C, 2022-03, Vol.126 (9), p.4563-4576

2022

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Alliacane-Type Secondary Metabolites from Submerged Cultures of the Basidiomycete Clitocybe nebularis

Trapping the Transition State in a [2,3]-Sigmatropic Rearrangement by Applying Pressure

On the Interplay Between Force, Temperature, and Electric Fields in the Rupture Process of Mechanophores

Synthesis and crystal structure of 2-(anthracen-9-yl)-1-(tert-butyldimethylsilyl)-3,6-dihydro-1λ4,2λ4-azaborinine

Complexation of Boron and Aluminum with a Bidentate Hydroxy-BN-naphthalene Ligand

Emergent Properties in Chemistry ‐ Relating Molecular Properties to Bulk Behavior

Investigating the accuracy of density functional methods for molecules in electric fields

JEDI: A versatile code for strain analysis of molecular and periodic systems under deformation

Calculating high-pressure vibrational frequencies analytically with the extended hydrostatic compression force field approach

An efficient implementation of the GOSTSHYP pressure model by applying shell-bounding Gaussian 1-electron-3-center integral screening

Multiscale Mechanochemical Modeling of Spiropyran–Merocyanine Isomerization in Linear PMMA Polymers

An in-silico NMR laboratory for nuclear magnetic shieldings computed via finite fields: Exploring nucleus-specific renormalizations of MP2 and MP3

Can a Finite Chain of Hydrogen Cyanide Molecules Model a Crystal?

Computational high‐pressure chemistry: Ab initio simulations of atoms, molecules, and extended materials in the gigapascal regime

Boosting quantum yields and circularly polarized luminescence of penta- and hexahelicenes by doping with two BN-groups

CREST—A program for the exploration of low-energy molecular chemical space

Notizen aus der Chemie

Nano-crystalline precursor formation, stability, and transformation to mullite-type visible-light photocatalysts

Notizen aus der Chemie

Notizen aus der Chemie

Notizen aus der Chemie

Synthesis and crystal structure of 2-(anthracen-9-yl)-1-( tert -butyldimethylsilyl)-3,6-dihydro-1λ 4 ,2λ 4 -azaborinine

Synthesis and crystal structure of 2-(anthracen-9-yl)-1-(tert-butyl-dimethyl-sil-yl)-3,6-di-hydro-1λ4,2λ4-aza-borinine

Notizen aus der Chemie

BN-Substitution in Dithienylpyrenes Prevents Excimer Formation in Solution and in the Solid State

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