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List of works by Jan Gerit Brandenburg

A new scheme for fixed node diffusion quantum Monte Carlo with pseudopotentials: Improving reproducibility and reducing the trial-wave-function bias

scientific article published on 01 October 2019

Challenges for large scale simulation: general discussion

scientific article published on 23 November 2020

Cost-effective composite methods for large-scale solid-state calculations

scientific article published on 21 September 2020

Extending and assessing composite electronic structure methods to the solid state

scientific article published on 01 September 2019

Fast and accurate quantum Monte Carlo for molecular crystals.

scientific article published on 5 February 2018

Free-energy landscape of polymer-crystal polymorphism

scientific article published on 01 October 2020

Interaction between water and carbon nanostructures: How good are current density functional approximations?

scientific article published on 01 October 2019

Metal–organic frameworks properties from hybrid density functional approximations

scientific article published in 2022

New approaches to study excited states in density functional theory: general discussion

scientific article published on 27 November 2020

New density-functional approximations and beyond: general discussion

scientific article published on 24 November 2020

On the hydrogen activation by frustrated Lewis pairs in the solid state: benchmark studies and theoretical insights

scientific article

Physisorption of Water on Graphene: Subchemical Accuracy from Many-Body Electronic Structure Methods

scientific article published on 10 January 2019

Solid state frustrated Lewis pair chemistry.

scientific article

Structure and Stability of Molecular Crystals with Many-Body Dispersion-Inclusive Density Functional Tight Binding

scientific article published on 3 January 2018

Thermal Expansion of Carbamazepine: Systematic Crystallographic Measurements Challenge Quantum Chemical Calculations

scientific article published on 25 August 2017

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