TUdatalib : Recently added

Data of the publication: Determination of Aqueous Solubility of NaCl in Molecular Dynamics Simulation using the Kirkwood-Buff Method

Abhishek Chattopadhyay; Mandalaparthy, Varun; van der Vegt, Nico (2025-01)

Ionization potentials of metal clusters studied with a broad range, tunable vacuum ultraviolet light source.

Macion, Alexander; Schäfer, Rolf (2023-08)

A Generic Model for pH-Sensitive Collapse of Hydrophobic Polymers

Mandalaparthy, Varun; van der Vegt, Nico (2024-12)

Cross-Correlations in the Fluctuation Dissipation Relation Influence Barrier Crossing Dynamics

Wolf, Niklas; Viktor, Klippenstein; Nico F. A., van der Vegt (2024-10-29)

Grafting and controlled release of antimicrobial peptides from mesoporous silica: Public data

Bagherabadi, Mohadeseh; Fleckenstein, Marie; Moskalyk, Oleksandr; Belluati, Andrea; Avrutina, Olga; Andrieu-Brunsen, Annette (2024)

Laser Writing of Block-Copolymer Images into Mesopores UsingSBDC-Initiated Visible-Light-Induced Polymerization:Public_Data

Förster, Claire; Lehn, Robert; Saritas, Enis Musa; Andrieu-Brunsen, Annette (2023)

Ultrashort Peptide Grafting on Mesoporous Films and Its Impact onIonic Mesopore Accessibility: Public_Data

Bagherabadi, Mohadeseh; Andrieu-Brunsen, Annette (2024)

3D Printing of Ordered Mesoporous Silica Using Light-Induced Sol-Gel Chemistry:Public-Data

Gluns, Johanna; Zhao, Lucy; Spiehl, Dieter; Mikolei, Joanna Judith; pardehkhorram, raheleh; Ceolin, Marcelo; Andrieu-Brunsen, Annette (2024)

Printing of In Situ Functionalized Mesoporous Silica with Digital Light Processing for Combinatorial Sensing: Public Data

Zhao, Lucy; Spiehl, Dieter; Kohnen, Marion; Ceolin, Marcelo; Mikolei, Joanna Judith; pardehkhorram, raheleh; Andrieu-Brunsen, Annette (2024)

Data of the publication: A Gauss-Newton method for iterative optimization of memory kernels for generalized Langevin thermostats in coarse-grained molecular dynamics simulations

Klippenstein, Viktor; Wolf, Niklas; van der Vegt, Nico (2024-04-17)

Transferable Local Density-Dependent Friction in tert-Butanol/Water Mixtures

Mathes, Moritz; Klippenstein, Viktor; van der Vegt, Nico (2024)

Molecular transport and water condensation inside mesopores with wettability step gradients: Public Data

Despot, Laura; Hinduja, Chirag; Lehn, Robert; Mikolei, Joanna; Richter, Timo; Köbschall, Kilian; Stanzel, Mathias; Berger, Rüdiger; Hussong, Jeanette; Ceolin, Marcelo; Andrieu-Brunsen, Annette (2023-10)

Effects of the Polymer Amount and pH on Proton Transport in Mesopores: Public Data

Despot, Laura; Andrieu-Brunsen, Annette (2023)

Data of the publication "Dynamical Coarse-grained Models of Molecular Liquids and their Ideal and Non-ideal Mixtures"

Tripathy, Madhusmita; Klippenstein, Viktor; van der Vegt, Nico (2023)

Visible light induced RAFT for asymmetric functionalization of silica mesopores: Public Data

Förster, Claire; Veith, Lothar; Andrieu-Brunsen, Annette (2022)

VBA-Routine for the Automation of High-Troughput Process Simulation

Hungsberg, Maximilian (2023)

Figure S20

Oefner, Niklas; Shuck, Christopher E.; Schumacher, Leon; Heck, Franziska; Hofmann, Kathrin; Schmidpeter, Jana; Li, Weiqun; Barhi, Mounib; Mehdi, B. Layla; Drochner, Alfons; Albert, Barbara; Hess, Christian; Gogotsi, Yury; Etzold, Bastian J. M. (2023)

Figure S17

Oefner, Niklas; Shuck, Christopher E.; Schumacher, Leon; Heck, Franziska; Hofmann, Kathrin; Schmidpeter, Jana; Li, Weiqun; Barhi, Mounib; Mehdi, B. Layla; Drochner, Alfons; Albert, Barbara; Hess, Christian; Gogotsi, Yury; Etzold, Bastian J. M. (2023)

Figure S9

Oefner, Niklas; Shuck, Christopher E.; Schumacher, Leon; Heck, Franziska; Hofmann, Kathrin; Schmidpeter, Jana; Li, Weiqun; Barhi, Mounib; Mehdi, B. Layla; Drochner, Alfons; Albert, Barbara; Hess, Christian; Gogotsi, Yury; Etzold, Bastian J. M. (2023)

Figure S13

Oefner, Niklas; Shuck, Christopher E.; Schumacher, Leon; Heck, Franziska; Hofmann, Kathrin; Schmidpeter, Jana; Li, Weiqun; Barhi, Mounib; Mehdi, B. Layla; Drochner, Alfons; Albert, Barbara; Hess, Christian; Gogotsi, Yury; Etzold, Bastian J. M. (2023)

07 Fachbereich Chemie: Recent submissions

Data of the publication: Determination of Aqueous Solubility of NaCl in Molecular Dynamics Simulation using the Kirkwood-Buff Method ﻿

Ionization potentials of metal clusters studied with a broad range, tunable vacuum ultraviolet light source. ﻿

A Generic Model for pH-Sensitive Collapse of Hydrophobic Polymers ﻿

Cross-Correlations in the Fluctuation Dissipation Relation Influence Barrier Crossing Dynamics ﻿

Grafting and controlled release of antimicrobial peptides from mesoporous silica: Public data ﻿

Laser Writing of Block-Copolymer Images into Mesopores UsingSBDC-Initiated Visible-Light-Induced Polymerization:Public_Data ﻿

Ultrashort Peptide Grafting on Mesoporous Films and Its Impact onIonic Mesopore Accessibility: Public_Data ﻿

3D Printing of Ordered Mesoporous Silica Using Light-Induced Sol-Gel Chemistry:Public-Data ﻿

Printing of In Situ Functionalized Mesoporous Silica with Digital Light Processing for Combinatorial Sensing: Public Data ﻿

Data of the publication: A Gauss-Newton method for iterative optimization of memory kernels for generalized Langevin thermostats in coarse-grained molecular dynamics simulations ﻿

Transferable Local Density-Dependent Friction in tert-Butanol/Water Mixtures ﻿

Molecular transport and water condensation inside mesopores with wettability step gradients: Public Data ﻿

Effects of the Polymer Amount and pH on Proton Transport in Mesopores: Public Data ﻿

Data of the publication "Dynamical Coarse-grained Models of Molecular Liquids and their Ideal and Non-ideal Mixtures" ﻿

Visible light induced RAFT for asymmetric functionalization of silica mesopores: Public Data ﻿

VBA-Routine for the Automation of High-Troughput Process Simulation ﻿

Figure S20 ﻿

Figure S17 ﻿

Figure S9 ﻿

Figure S13 ﻿

Data of the publication: Determination of Aqueous Solubility of NaCl in Molecular Dynamics Simulation using the Kirkwood-Buff Method

Ionization potentials of metal clusters studied with a broad range, tunable vacuum ultraviolet light source.

A Generic Model for pH-Sensitive Collapse of Hydrophobic Polymers

Cross-Correlations in the Fluctuation Dissipation Relation Influence Barrier Crossing Dynamics

Grafting and controlled release of antimicrobial peptides from mesoporous silica: Public data

Laser Writing of Block-Copolymer Images into Mesopores UsingSBDC-Initiated Visible-Light-Induced Polymerization:Public_Data

Ultrashort Peptide Grafting on Mesoporous Films and Its Impact onIonic Mesopore Accessibility: Public_Data

3D Printing of Ordered Mesoporous Silica Using Light-Induced Sol-Gel Chemistry:Public-Data

Printing of In Situ Functionalized Mesoporous Silica with Digital Light Processing for Combinatorial Sensing: Public Data

Data of the publication: A Gauss-Newton method for iterative optimization of memory kernels for generalized Langevin thermostats in coarse-grained molecular dynamics simulations

Transferable Local Density-Dependent Friction in tert-Butanol/Water Mixtures

Molecular transport and water condensation inside mesopores with wettability step gradients: Public Data

Effects of the Polymer Amount and pH on Proton Transport in Mesopores: Public Data

Data of the publication "Dynamical Coarse-grained Models of Molecular Liquids and their Ideal and Non-ideal Mixtures"

Visible light induced RAFT for asymmetric functionalization of silica mesopores: Public Data

VBA-Routine for the Automation of High-Troughput Process Simulation

Figure S20

Figure S17

Figure S9

Figure S13