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Publikationen (verstecken)4387
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1Conceptual Ruedenberg theory of chemical bonds : the necessary step beyond conceptual DFT
L. Szentpály. Chemical Reactivity, 1 : Theories and principles, chapter 5, Elsevier, Amsterdam, (2023)
13 days ago by @unibiblio
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2Introduction to Chemical Reactivity
L. Szentpály, and S. Kaya. Chemical Reactivity, 1 : Theories and Principles, Elsevier, Amsterdam, (2023)
13 days ago by @unibiblio
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1Titelbild: Verwendung der Struktur und Dynamik der Squalen-Hopen-Zyklase für die (−)-Ambroxid Produktion (Angew. Chem. 22/2023)
A. Schneider, C. Curado, T. Lystbaek, S. Osuna, and B. Hauer. Angewandte Chemie, 135 (22): e202305546 (2023)
13 days ago by @unibiblio
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1Cover Picture: Harnessing the Structure and Dynamics of the Squalene-Hopene Cyclase for (−)-Ambroxide Production (Angew. Chem. Int. Ed. 22/2023)
A. Schneider, C. Curado, T. Lystbaek, S. Osuna, and B. Hauer. Angewandte Chemie. International Edition, 62 (22): e202305546 (2023)
13 days ago by @unibiblio
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3Precursor molecules for cobalt(II) single molecule magnets : Synthesis and magnetic properties
D. Hunger, S. Suhr, V. Bayer, U. Albold, B. Sarkar, and J. Slageren. Preprint, (2023)
15 days ago by @unibiblio
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1Autonomous Adaption of Intelligent Humidity-Programmed Hydrogel Patches for Tunable Stiffness and Drug Release (Adv. Mater. Technol. 19/2023)
S. Pflumm, Y. Wiedemann, D. Fauser, J. Safaraliyev, D. Lunter, H. Steeb, and S. Ludwigs. Advanced Materials Technologies, 8 (19): 2370097 (2023)
15 days ago by @unibiblio
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1Operando Elemental Imaging Using SIMS : Correlative Structural, Chemical, and Electrochemical Analysis of Solid-state Batteries
L. Cressa, Y. Sun, D. Andersen, M. Nojambee, M. Gerard, T. Wirtz, and S. Eswara. Microscopy and microanalysis, 29 (S1): 1289-1290 (2023)
15 days ago by @unibiblio
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1Direct Imaging of Lattice Structure and Formation Kinetics of Metal-organic Layer Composites
H. Wang, H. Liu, Q. Song, E. Klemm, and P. Aken. Microscopy and microanalysis, 29 (S1): 1318-1319 (2023)
15 days ago by @unibiblio
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1Nachweis von Allergenspuren in Lebensmitteln mittels affinity capture LC-MS/MS : „proof of principles“
A. Kehrer, R. Fasold, I. Hansen, and J. Brockmeyer. Abstracts der Vorträge der Regionalverbände und die der Posterflashtalks der AG JLC, 77, S1, page S1-S45. Wiley-VCH, (2023)
15 days ago by @unibiblio
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1Identifizierung Raps-assoziierter Peptidmarker zum Nachweis des floralen Ursprungs in Rapshonig mittels LC-MS/MS
I. Richter, S. Murr, and J. Brockmeyer. Abstracts der Vorträge der Regionalverbände und die der Posterflashtalks der AG JLC, 77, S1, Wiley-VCH, (2023)
15 days ago by @unibiblio
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5Comprehensive Quantum Chemical Analysis of the (Ro)Vibrational Spectrum of Thiirane and its Deuterated Isotopologue
J. De Vos, B. Schröder, and G. Rauhut. Spectrochimica acta. A, Molecular and biomolecular spectroscopy, (2023)
19 days ago by @unibiblio
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1A donor-supported silavinylidene and silylium ylides: boroles as a flexible platform for versatile Si( ii ) chemistry
J. Sarcevic, T. Heitkemper, P. Ruth, L. Naß, M. Kubis, D. Stalke, and C. Sindlinger. Chemical science, 14 (19): 5148-5159 (2023)
20 days ago by @unibiblio
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1Spinodal Decomposition of B2-phase and Formation of Cr-Rich Nano-precipitates in AlCoCrFeNi2.1 Eutectic High-Entropy Alloy
J. Charkhchian, A. Zarei-Hanzaki, A. Moshiri, H. Abedi, T. Schwarz, R. Lawitzki, G. Schmitz, K. Chadha, C. Aranas, J. Shen and 1 other author(s). Advanced engineering materials, (2023)
20 days ago by @unibiblio
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1Processing of hydroxylamine, NH2OH, an important prebiotic precursor, on interstellar ices
G. Molpeceres, V. Rivilla, K. Furuya, J. Kästner, B. Maté, and Y. Aikawa. Monthly notices of the Royal Astronomical Society, 521 (4): 6061-6074 (2023)
20 days ago by @unibiblio
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1Mixed Valency in Ligand-Bridged Diruthenium Complexes
S. Dey, S. Bera, W. Kaim, and G. Lahiri. Mixed-Valence Systems : Fundamentals, Synthesis, Electron Transfer, and Applications, chapter 4, Wiley-VCH, Weinheim, (2023)
20 days ago by @unibiblio
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1Towards Recycling of All-Solid-State Batteries with Argyrodite Sulfide Electrolytes : Insights into Electrolyte and Electrode Degradation in Dissolution-Based Separation Processes
K. Wissel, Z. Hu, X. Wu, M. Jacob, K. Küster, U. Starke, and O. Clemens. ChemSusChem, 18 (9): e202402128 (2025)
22 days ago by @unibiblio
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1Leveraging N-exo substituents to tune the donor/ acceptor properties of mesoionic imines (MIIs)
R. Rudolf, A. Todorovski, H. Schubert, and B. Sarkar. Dalton transactions, 54 (8): 3305–3313 (2025)
22 days ago by @unibiblio
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3Simplified Multireference Coupled-Cluster Methods : Hybrid Approaches With Averaged Coupled Pair Theories
A. Waigum, S. Suchaneck, and A. Köhn. Journal of computational chemistry, 46 (3): e70020 (2025)
22 days ago by @unibiblio
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1Structure-Guided Engineering of Oleate Hydratase for the Synthesis of Small Chiral Alcohols without Decoy Molecule
N. Härterich, A. Schneider, P. Horz, N. Travnicek, and B. Hauer. Advanced synthesis & catalysis, 367 (8): e202401358 (2025)
22 days ago by @unibiblio
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1Model-Driven Optimisation of Monitoring System Configurations for Batch Production
A. Margraf, H. Cui, S. Heimbach, J. Hähner, S. Geinitz, and S. Rudolph. Proceedings of the 11th International Conference on Model-Based Software and Systems Engineering, page 176-183. Setúbal, SciTePress, (2023)
22 days ago by @unibiblio
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1Conceptual Ruedenberg theory of chemical bonds : the necessary step beyond conceptual DFT

2Introduction to Chemical Reactivity

1Titelbild: Verwendung der Struktur und Dynamik der Squalen-Hopen-Zyklase für die (−)-Ambroxid Produktion (Angew. Chem. 22/2023)

1Cover Picture: Harnessing the Structure and Dynamics of the Squalene-Hopene Cyclase for (−)-Ambroxide Production (Angew. Chem. Int. Ed. 22/2023)

3Precursor molecules for cobalt(II) single molecule magnets : Synthesis and magnetic properties

1Autonomous Adaption of Intelligent Humidity-Programmed Hydrogel Patches for Tunable Stiffness and Drug Release (Adv. Mater. Technol. 19/2023)

1Operando Elemental Imaging Using SIMS : Correlative Structural, Chemical, and Electrochemical Analysis of Solid-state Batteries

1Direct Imaging of Lattice Structure and Formation Kinetics of Metal-organic Layer Composites

1Nachweis von Allergenspuren in Lebensmitteln mittels affinity capture LC-MS/MS : „proof of principles“

1Identifizierung Raps-assoziierter Peptidmarker zum Nachweis des floralen Ursprungs in Rapshonig mittels LC-MS/MS

5Comprehensive Quantum Chemical Analysis of the (Ro)Vibrational Spectrum of Thiirane and its Deuterated Isotopologue

1A donor-supported silavinylidene and silylium ylides: boroles as a flexible platform for versatile Si( ii ) chemistry

1Spinodal Decomposition of B2-phase and Formation of Cr-Rich Nano-precipitates in AlCoCrFeNi2.1 Eutectic High-Entropy Alloy

1Processing of hydroxylamine, NH2OH, an important prebiotic precursor, on interstellar ices

1Mixed Valency in Ligand-Bridged Diruthenium Complexes

1Towards Recycling of All-Solid-State Batteries with Argyrodite Sulfide Electrolytes : Insights into Electrolyte and Electrode Degradation in Dissolution-Based Separation Processes

1Leveraging N-exo substituents to tune the donor/ acceptor properties of mesoionic imines (MIIs)

3Simplified Multireference Coupled-Cluster Methods : Hybrid Approaches With Averaged Coupled Pair Theories

1Structure-Guided Engineering of Oleate Hydratase for the Synthesis of Small Chiral Alcohols without Decoy Molecule

1Model-Driven Optimisation of Monitoring System Configurations for Batch Production

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