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Scientific Reports|October 24, 2012
Theoretical investigation of the magnetic exchange interactions in copper(II) oxides under chemical and physical pressuresXavier Rocquefelte, Karlheinz Schwarz, Peter Blaha
Journal of Chemical Theory and Computation|October 27, 2015
How close are the Slater and Becke-Roussel potentials in solids?Fabien Tran, Peter Blaha, Karlheinz Schwarz
Physical Review Letters|December 17, 2004
Geometric frustration, electronic instabilities, and charge singlets in Y2Nb2O7P Blaha, D J Singh, K Schwarz
Journal of Physics. Condensed Matter : an Institute of Physics Journal|August 6, 2011
Density functional theory simulations of B K and N K NEXAFS spectra of h-BN/transition metal(111) interfacesR Laskowski, Th Gallauner, P Blaha, et al.
Physical Review Letters|March 16, 2007
Single-layer model of the hexagonal boron nitride nanomesh on the Rh(111) surfaceRobert Laskowski, Peter Blaha, Thomas Gallauner, et al.
Ultramicroscopy|May 11, 2000
The orientation-dependent simulation of ELNESHebert-Souche, Louf, Blaha, et al.
Physical Review Letters|September 16, 2000
Complex band structure and tunneling through ferromagnet /Insulator /Ferromagnet junctionsMavropoulos, Papanikolaou, Dederichs
Acta Crystallographica. Section A, Foundations of Crystallography|October 27, 2001
Electron-density distribution in stishovite, SiO2: a new high-energy synchrotron-radiation studyA Kirfel, H G Krane, P Blaha, et al.
Nature Communications|September 24, 2013
Room-temperature spin-spiral multiferroicity in high-pressure cupric oxideXavier Rocquefelte, Karlheinz Schwarz, Peter Blaha, et al.
Physical Review Letters|November 3, 2001
Correlation induced paramagnetic ground state in FeAlP Mohn, C Persson, P Blaha, et al.
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