Tim Neudecker

Affiliations

Institute for Physical and Theoretical Chemistry, University of Bremen, Leobener Straße 7, D-28359 Bremen, Germany.
MAPEX Center for Materials and Processes, University of Bremen, Bibliothekstraße 1, D-28359 Bremen, Germany.
Bremen Center for Computational Materials Science, University of Bremen, Am Fallturm 1, D-28359 Bremen, Germany.

ORCID: https://orcid.org/0000-0001-7599-3578

Publications (15)

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

The journal of physical chemistry. C, Nanomaterials and interfaces

Avec: Yannik Appiarius , Philipp J Gliese , Stephan A W Segler , Pascal Rusch , Jiangbin Zhang , Paul J Gates , Rumpa Pal , Lorraine A Malaspina , Kunihisa Sugimoto , Tim Neudecker , Nadja C Bigall , Simon Grabowsky , Artem A Bakulin , Anne Staubitz

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

Chemphyschem : a European journal of chemical physics and physical chemistry

Avec: Chieh-Min Hsieh , Björn Grabbet , Felix Zeller , Sanna Benter , Tarek Scheele , Norman Sieroka , Tim Neudecker

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

The Journal of chemical physics

Avec: Felix Zeller , Eric Berquist , Evgeny Epifanovsky , Tim Neudecker

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

ACS omega

Avec: Sourabh Kumar , Rahel Weiß , Felix Zeller , Tim Neudecker

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

Chemical science

Avec: Yannik Appiarius , Sandra Míguez-Lago , Pim Puylaert , Noah Wolf , Sourabh Kumar , Martin Molkenthin , Delia Miguel , Tim Neudecker , Michal Juríček , Araceli G Campaña , Anne Staubitz

Alliacane-Type Secondary Metabolites from Submerged Cultures of the Basidiomycete

Journal of natural products

Avec: Hedda Schrey , Tarek Scheele , Conrad Ulonska , Dana Leoni Nedder , Tim Neudecker , Peter Spiteller , Marc Stadler

Using oriented external electric fields to manipulate rupture forces of mechanophores.

Physical chemistry chemical physics : PCCP

Avec: Tarek Scheele , Tim Neudecker

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

The Journal of chemical physics

Avec: Philipp Pracht , Stefan Grimme , Christoph Bannwarth , Fabian Bohle , Sebastian Ehlert , Gereon Feldmann , Johannes Gorges , Marcel Müller , Tim Neudecker , Christoph Plett , Sebastian Spicher , Pit Steinbach , Patryk A Wesołowski , Felix Zeller

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

Chemphyschem : a European journal of chemical physics and physical chemistry

Avec: Tarek Scheele , Tim Neudecker

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

The Journal of chemical physics

Avec: Henry Wang , Sanna Benter , Wilke Dononelli , Tim Neudecker

Emergent Properties in Chemistry - Relating Molecular Properties to Bulk Behavior.

Chemistry (Weinheim an der Bergstrasse, Germany)

Avec: Norman Sieroka , Tammo Lossau , Tim Neudecker

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

Avec: Jonathan Wong , Brad Ganoe , Xiao Liu , Tim Neudecker , Joonho Lee , Jiashu Liang , Zhe Wang , Jie Li , Adam Rettig , Teresa Head-Gordon , Martin Head-Gordon

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

The Journal of chemical physics

Avec: Rahel Weiß , Felix Zeller , Tim Neudecker

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

The Journal of chemical physics

Avec: Tarek Scheele , Tim Neudecker

Synthesis and crystal structure of 2-(anthracen-9-yl)-1-(

Acta crystallographica. Section E, Crystallographic communications

Avec: Philipp J Gliese , Yannik Appiarius , Tarek Scheele , Enno Lork , Tim Neudecker , Anne Staubitz

Réseau de co-auteurs

Tarek Scheele 6 collaborations

Felix Zeller 5 collaborations

Yannik Appiarius 3 collaborations

Anne Staubitz 3 collaborations

Philipp J Gliese 2 collaborations

Sanna Benter 2 collaborations

Norman Sieroka 2 collaborations

Sourabh Kumar 2 collaborations

Rahel Weiß 2 collaborations

Stephan A W Segler 1 collaboration

Pascal Rusch 1 collaboration

Jiangbin Zhang 1 collaboration

Paul J Gates 1 collaboration

Rumpa Pal 1 collaboration

Lorraine A Malaspina 1 collaboration

Kunihisa Sugimoto 1 collaboration

Nadja C Bigall 1 collaboration

Simon Grabowsky 1 collaboration

Artem A Bakulin 1 collaboration

Chieh-Min Hsieh 1 collaboration

Björn Grabbet 1 collaboration

Eric Berquist 1 collaboration

Evgeny Epifanovsky 1 collaboration

Sandra Míguez-Lago 1 collaboration

Pim Puylaert 1 collaboration

Noah Wolf 1 collaboration

Martin Molkenthin 1 collaboration

Delia Miguel 1 collaboration

Michal Juríček 1 collaboration

Araceli G Campaña 1 collaboration

Hedda Schrey 1 collaboration

Conrad Ulonska 1 collaboration

Dana Leoni Nedder 1 collaboration

Peter Spiteller 1 collaboration

Marc Stadler 1 collaboration

Philipp Pracht 1 collaboration

Stefan Grimme 1 collaboration

Christoph Bannwarth 1 collaboration

Fabian Bohle 1 collaboration

Sebastian Ehlert 1 collaboration

Gereon Feldmann 1 collaboration

Johannes Gorges 1 collaboration

Marcel Müller 1 collaboration

Christoph Plett 1 collaboration

Sebastian Spicher 1 collaboration

Pit Steinbach 1 collaboration

Patryk A Wesołowski 1 collaboration

Henry Wang 1 collaboration

Wilke Dononelli 1 collaboration

Tammo Lossau 1 collaboration

Jonathan Wong 1 collaboration

Brad Ganoe 1 collaboration

Xiao Liu 1 collaboration

Joonho Lee 1 collaboration

Jiashu Liang 1 collaboration

Zhe Wang 1 collaboration

Jie Li 1 collaboration

Adam Rettig 1 collaboration

Teresa Head-Gordon 1 collaboration

Martin Head-Gordon 1 collaboration

Enno Lork 1 collaboration