Thomas Heine
Thomas Heine
Professor of Theoretical Chemistry
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Influence of quantum confinement on the electronic structure of the transition metal sulfide T S 2
A Kuc, N Zibouche, T Heine
Physical Review B 83 (24), 245213, 2011
An atlas of two-dimensional materials
P Miró, M Audiffred, T Heine
Chemical Society Reviews 43 (18), 6537-6554, 2014
Construction of crystalline 2D covalent organic frameworks with remarkable chemical (acid/base) stability via a combined reversible and irreversible route
S Kandambeth, A Mallick, B Lukose, MV Mane, T Heine, R Banerjee
Journal of the American Chemical Society 134 (48), 19524-19527, 2012
Graphene nanostructures as tunable storage media for molecular hydrogen
S Patchkovskii, ST John, SN Yurchenko, L Zhechkov, T Heine, G Seifert
Proceedings of the National Academy of Sciences 102 (30), 10439-10444, 2005
Mechanochemical synthesis of chemically stable isoreticular covalent organic frameworks
BP Biswal, S Chandra, S Kandambeth, B Lukose, T Heine, R Banerjee
Journal of the American Chemical Society 135 (14), 5328-5331, 2013
Induced magnetic fields in aromatic [n]-annulenes—interpretation of NICS tensor components
C Corminboeuf, T Heine, G Seifert, P von Rague Schleyer, J Weber
Physical Chemistry Chemical Physics 6 (2), 273-276, 2004
Chemically stable multilayered covalent organic nanosheets from covalent organic frameworks via mechanical delamination
S Chandra, S Kandambeth, BP Biswal, B Lukose, SM Kunjir, ...
Journal of the American Chemical Society 135 (47), 17853-17861, 2013
Two-dimensional sp2 carbon–conjugated covalent organic frameworks
E Jin, M Asada, Q Xu, S Dalapati, MA Addicoat, MA Brady, H Xu, ...
Science 357 (6352), 673-676, 2017
A stable non-classical metallofullerene family
S Stevenson, PW Fowler, T Heine, JC Duchamp, G Rice, T Glass, ...
Nature 408 (6811), 427-428, 2000
Mixed Matrix Membranes (MMMs) Comprising Exfoliated 2D Covalent Organic Frameworks (COFs) for Efficient CO2 Separation
Z Kang, Y Peng, Y Qian, D Yuan, MA Addicoat, T Heine, Z Hu, L Tee, ...
Chemistry of Materials 28 (5), 1277-1285, 2016
Chemical sensing in two dimensional porous covalent organic nanosheets
G Das, BP Biswal, S Kandambeth, V Venkatesh, G Kaur, M Addicoat, ...
Chemical science 6 (7), 3931-3939, 2015
Highly emissive covalent organic frameworks
S Dalapati, E Jin, M Addicoat, T Heine, D Jiang
Journal of the American Chemical Society 138 (18), 5797-5800, 2016
An Efficient a Posteriori Treatment for Dispersion Interaction in Density-Functional-Based Tight Binding
L Zhechkov, T Heine, S Patchkovskii, G Seifert, HA Duarte
Journal of Chemical Theory and Computation 1 (5), 841-847, 2005
Enhancement of chemical stability and crystallinity in porphyrin‐containing covalent organic frameworks by intramolecular hydrogen bonds
S Kandambeth, DB Shinde, MK Panda, B Lukose, T Heine, R Banerjee
Angewandte Chemie International Edition 52 (49), 13052-13056, 2013
On the mechanical behavior of WS2 nanotubes under axial tension and compression
I Kaplan-Ashiri, SR Cohen, K Gartsman, V Ivanovskaya, T Heine, G Seifert, ...
Proceedings of the National Academy of Sciences 103 (3), 523-528, 2006
The induced magnetic field in cyclic molecules
G Merino, T Heine, G Seifert
Chemistry–A European Journal 10 (17), 4367-4371, 2004
Solid state organic amine detection in a photochromic porous metal organic framework
A Mallick, B Garai, MA Addicoat, PS Petkov, T Heine, R Banerjee
Chemical science 6 (2), 1420-1425, 2015
Transition metal chalcogenides: ultrathin inorganic materials with tunable electronic properties
T Heine
Accounts of chemical research 48 (1), 65-72, 2015
Strain-dependent modulation of conductivity in single-layer transition-metal dichalcogenides
M Ghorbani-Asl, S Borini, A Kuc, T Heine
Physical Review B 87 (23), 235434, 2013
Two-Dimensional Cu2Si Monolayer with Planar Hexacoordinate Copper and Silicon Bonding
LM Yang, V Bacic, IA Popov, AI Boldyrev, T Heine, T Frauenheim, E Ganz
Journal of the American Chemical Society 137 (7), 2757-2762, 2015
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