JuLib | Articles & more - {"Theoretische Nanoelektronik; IAS-3"}

1

Talk (non-conference)

Massively parallel DFT

Zeller, Rudolf
2014

2014

“...Theoretische Nanoelektronik; IAS-3 Theoretische Nanoelektronik...”

2

Poster

Large-scale density functional theory study of phosphorus-doped silicon

Xu, P.
2014

2014

“...Theoretische Nanoelektronik; IAS-3 Theoretische Nanoelektronik...”

3

Talk (non-conference)

DFT on supercomputers

Zeller, Rudolf
2014

2014

“...Theoretische Nanoelektronik; IAS-3 Theoretische Nanoelektronik...”

4

Contribution to a book
Contribution to a conference proceedings

DFT on supercomputers

Zeller, Rudolf
2014

2014

“...Theoretische Nanoelektronik; IAS-3 Theoretische Nanoelektronik...”

5

Journal Article

First-principles study of magnetic interactions in $3d$ transition metal-doped phase-change materials

Fukushima, T.
2014

Physical Review B Physical review / B, 90 90 (2014 2014) 14 14, S. 144417 144417

“...Theoretische Nanoelektronik; IAS-3 Theoretische Nanoelektronik...”
OpenAccess

6

Conference Presentation

Large scale supercell calculations for forces around substitutional defects in NiTi

Zeller, Rudolf
2014

2014

“...Theoretische Nanoelektronik; IAS-3 Theoretische Nanoelektronik...”

7

Conference Presentation

KKRnano: DFT for nano-scale systems

Rabel, Elias
2014

2014

“...Theoretische Nanoelektronik; IAS-3 Theoretische Nanoelektronik...”

8

Conference Presentation

Large-scale density functional theory study of localization of donor electrons in phosphorus-doped silicon

Xu, Pengxiang
2014

2014

“...Theoretische Nanoelektronik; IAS-3 Theoretische Nanoelektronik...”

9

Journal Article

Hubbard U calculations for gap states in dilute magnetic semiconductors

Fukushima, T.
2014

Journal of physics / Condensed matter, 26 (2014) 27, S. 274202

“...Theoretische Nanoelektronik; IAS-3 Theoretische Nanoelektronik...”

10

Poster

KKRnano: Improvements in efficiency and order-N scaling for use on massively parallel computers

Rabel, Elias
2013

“...Theoretische Nanoelektronik; IAS-3 Theoretische Nanoelektronik...”

11

Conference Presentation

Metal-Insulator Transitions of Crystalline Phase-Change Materials

Zhang, Wei
2013

“...Theoretische Nanoelektronik; IAS-3 Theoretische Nanoelektronik...”

12

Conference Presentation

Complex Magnetism in Fe nanoclusters on Ir(111)

Bauer, David
2013

“...Theoretische Nanoelektronik; IAS-3 Theoretische Nanoelektronik...”

13

Journal Article

Projection potentials and angular momentum convergence of total energies in the full-potential Korringa–Kohn–Rostoker method

Zeller, Rudolf
2013

Journal of physics / Condensed matter, 25 10, S. 105505 -

“...Theoretische Nanoelektronik; IAS-3 Theoretische Nanoelektronik...”

14

Poster

Extending the length scale of accurate density-functional calculations

Zeller, Rudolf
2013

“...Theoretische Nanoelektronik; IAS-3 Theoretische Nanoelektronik...”

15

Poster

Projection potentials and total energy convergence in the KKR method

Zeller, Rudolf
2013

“...Theoretische Nanoelektronik; IAS-3 Theoretische Nanoelektronik...”

16

Conference Presentation

Precise density functional calculations for large systems with KKRnano

Zeller, Rudolf
2013

“...Theoretische Nanoelektronik; IAS-3 Theoretische Nanoelektronik...”

17

Conference Presentation

Metal-Insulator Transitions in Crystalline Phase Change Materials

Zhang, W.
2013

“...Theoretische Nanoelektronik; IAS-3 Theoretische Nanoelektronik...”

18

Conference Presentation

Condensed Matter Codes - Potential Application of Active Storage

Baumeister, Paul
2013

“...Theoretische Nanoelektronik; IAS-3 Theoretische Nanoelektronik...”

19

Conference Presentation

DFT-based Green function approach for impurity calculations

Zeller, Rudolf
2012

“...Theoretische Nanoelektronik; IAS-3 Theoretische Nanoelektronik...”

20

Talk (non-conference)

Precise density functional calculations for thousands of atoms

Zeller, Rudolf
2012

“...Theoretische Nanoelektronik; IAS-3 Theoretische Nanoelektronik...”

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