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T. Thonhauser

37 papers hereh-index 4715.3k citations162 works total

Matching runs newest-first, so older work may not be attached to this profile yet.

author position
  • sole author1
  • first author6
  • middle author10
  • last author18

Across the 35 of 37 papers where every author was matched, so the position is known.

fields
  • cond-mat.mtrl-sci33
  • physics.chem-ph2
  • cond-mat.supr-con1
  • physics.bio-ph1
same name
  • T. Thonhauser — 1 paper, h 7

Either other researchers who publish under this name, or the same person where the external sources have not merged their records.

identity via Semantic Scholar / OpenAlex

activity
20032020
most citedAdvanced capabilities for materials modelling with Quantum ESPRESSO

7.7k citations · 13.8k across the 37 of their papers we have counts for

collaborators
Showing 2013 · cond-mat.mtrl-sciShow all

2 papers · 2 filters

cond-mat.mtrl-sci2013★ 150 cited

Mechanism of preferential adsorption of SO2​ into two microporous paddle wheel frameworks M(bdc)(ted)0.5

Kui Tan, Pieremanuele Canepa, Qihan Gong +7

The selective adsorption of a corrosive gas, SO2​, into two microporous pillared paddle-wheel frameworks M(bdc)(ted)0.5 [M = Ni, Zn; bdc = 1,4-benzenedicarboxylate; ted = triethy…

cond-mat.mtrl-sci2013★ 72 cited

When metal organic frameworks turn into linear magnets

Pieremanuele Canepa, Yves J. Chabal, T. Thonhauser

We investigate the existence of linear magnetism in the metal organic framework materials MOF-74-Fe, MOF-74-Co, and MOF-74-Ni, using first-principles density functional theory. MOF…

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Not affiliated with arXiv. Researcher data from Semantic Scholar (ODC-BY) and OpenAlex.