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Physical Review. E, Statistical, Nonlinear, and Soft Matter Physics|November 13, 2009
Quantized liquid density-functional theory for hydrogen adsorption in nanoporous materialsSerguei Patchkovskii, Thomas HeinePhysical Chemistry Chemical Physics : PCCP|July 14, 2007
Evaluation of the adsorption free energy of light guest molecules in nanoporous host structuresSerguei Patchkovskii, Thomas HeineAngewandte Chemie (International Ed. in English)|June 4, 2023
A Thiophene Backbone Enables Two-Dimensional Poly(arylene vinylene)s with High Charge Carrier MobilityYamei Liu, Heng Zhang, Hongde Yu, et al.Accounts of Chemical Research|July 11, 2023
Chemical Doping of Organic and Coordination Polymers for Thermoelectric and Spintronic Applications: A Theoretical UnderstandingDong Wang, Hongde Yu, Wen Shi, et al.Chemistry (Weinheim an Der Bergstrasse, Germany)|January 25, 2011
The structure of layered covalent-organic frameworksBinit Lukose, Agnieszka Kuc, Thomas HeineMagnetic Resonance in Chemistry : MRC|September 15, 2004
13C NMR fingerprint characterizes long time-scale structure of Sc3N@C80 endohedral fullereneThomas Heine, Knut Vietze, Gotthard SeifertPhysical Review Letters|August 6, 2013
Stacking in bulk and bilayer hexagonal boron nitrideGabriel Constantinescu, Agnieszka Kuc, Thomas HeineChemical Society Reviews|May 15, 2014
An atlas of two-dimensional materialsPere Miró, Martha Audiffred, Thomas HeinePhysical Chemistry Chemical Physics : PCCP|January 12, 2016
A kinetic study on the reduction of CO2 by frustrated Lewis pairs: from understanding to rational designLei Liu, Nina Vankova, Thomas HeineJournal of Chemical Theory and Computation|December 3, 2015
Structure and Electron Delocalization in Al4(2-) and Al4(4.)Rafael Islas, Thomas Heine, Gabriel MerinoPageof 29