List of works - Michael Fischer

"Explosive" synthesis of metal-formate frameworks for methane capture: an experimental and computational study.

scientific article published on 4 October 2017

A Multifaceted Study of Methane Adsorption in Metal-Organic Frameworks by Using Three Complementary Techniques

scientific article published on 14 May 2018

Accurate structures and energetics of neutral-framework zeotypes from dispersion-corrected DFT calculations

scientific article published on May 2017

An interpenetrated metal-organic framework and its gas storage behavior: simulation and experiment

scientific article published on 10 October 2011

Benchmarking of GGA density functionals for modeling structures of nanoporous, rigid and flexible MOFs

scientific article published on 01 August 2018

Benchmarking the performance of approximate van der Waals methods for the structural and energetic properties of SiO2 and AlPO4 frameworks

scientific article published on 01 March 2019

Cation-exchanged SAPO-34 for adsorption-based hydrocarbon separations: predictions from dispersion-corrected DFT calculations

scientific article published on 27 May 2014

Computational evaluation of aluminophosphate zeotypes for CO2/N2 separation.

scientific article published on 16 August 2017

Crystal chemical characterization of mullite-type aluminum borate compounds

scholarly article by K. Hoffmann et al published March 2017 in Journal of Solid State Chemistry

Elucidating the Germanium Distribution in ITQ‐13 Zeolites by Density Functional Theory**

scientific article published on 17 February 2022

First-Principles Study of AlPO₄-H3, a Hydrated Aluminophosphate Zeotype Containing Two Different Types of Adsorbed Water Molecules

scientific article published on 06 March 2019

Interaction of water with (silico)aluminophosphate zeotypes: a comparative investigation using dispersion-corrected DFT

scientific article published on 26 May 2016

KLi2RE(BO3)2 (RE = Dy, Ho, Er, Tm, Yb, and Y): Structural, Spectroscopic, And Thermogravimetric Studies on a Series of Mixed-Alkali Rare-Earth Orthoborates

scientific article published on 11 December 2020

Modeling adsorption in metal-organic frameworks with open metal sites: propane/propylene separations.

scientific article published on 22 May 2012

Molecular structure of diethylaminoalane in the solid state: an X-ray powder diffraction, DFT calculation and Raman spectroscopy study

scientific article published on 01 April 2016

New Model for Predicting Adsorption of Polar Molecules in Metal-Organic Frameworks with Unsaturated Metal Sites

scientific article published on 14 June 2018

New microporous materials for acetylene storage and C(2)H(2)/CO(2) separation: insights from molecular simulations.

scientific article published in July 2010

Porous M(II)/pyrimidine-4,6-dicarboxylato neutral frameworks: synthetic influence on the adsorption capacity and evaluation of CO2-adsorbent interactions

scientific article published on 08 January 2014

Preferred hydrogen adsorption sites in various MOFs--a comparative computational study

scientific article published on 01 October 2009

Proton Acidity and Proton Mobility in ECR-40, a Silicoaluminophosphate that Violates Löwenstein's Rule

scientific article published on 20 September 2019

Structure and stability of Cd2Nb2O7 and Cd2Ta2O7 explored by ab initio calculations

scholarly article in Physical Review B, vol. 78 no. 1, July 2008

Water adsorption in SAPO-34: elucidating the role of local heterogeneities and defects using dispersion-corrected DFT calculations

scientific article published on 01 October 2015

What Is Being Measured with P-Bearing NMR Probe Molecules Adsorbed on Zeolites?

scientific article published on 19 August 2021

List of works by Michael Fischer