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Universit'e catholique de Louvain

2 papers here

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fields
  • cond-mat.mtrl-sci1
  • cs.DL1

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most citedHybrid exchange-correlation functional for accurate prediction of the electronic and structural properties of ferroelectric oxides

378 citations · 378 across the 2 of their papers we have counts for

collaborators

2 papers

cond-mat.mtrl-sci2008★ 378 cited

Hybrid exchange-correlation functional for accurate prediction of the electronic and structural properties of ferroelectric oxides

D. I. Bilc, R. Orlando, R. Shaltaf +3

Using a linear combination of atomic orbitals approach, we report a systematic comparison of various Density Functional Theory (DFT) and hybrid exchange-correlation functionals for…

cs.DL2008

Specification of an extensible and portable file format for electronic structure and crystallographic data

X. Gonze, C. -O. Almbladh, A. Cucca +6

In order to allow different software applications, in constant evolution, to interact and exchange data, flexible file formats are needed. A file format specification for different…

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