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1

DFTB+, a Sparse Matrix-Based Implementation of the DFTB Method †

Aradi, B., Hourahine, B., Frauenheim, Th.

Journal:

Journal of Physical Chemistry A

Year:

2007

Language:

english

File:

PDF, 167 KB

english, 2007

2

Money on the move: Opportunities for financial service providers in the ‘third space’

Hourahine, Ben, Howard, Melanie

Journal:

Journal of Financial Services Marketing

Year:

2004

Language:

english

File:

PDF, 204 KB

english, 2004

3

Critical impact of Ehrlich-Schwöbel barrier on GaN surface morphology during homoepitaxial growth

Kaufmann, Nils. A.K., Lahourcade, L., Hourahine, B., Martin, D., Grandjean, N.

Journal:

Journal of Crystal Growth

Year:

2015

Language:

english

File:

PDF, 2.46 MB

english, 2015

4

A real-time time-dependent density functional tight-binding implementation for semiclassical excited state electron-nuclear dynamics and pump-probe spectroscopy simulations

BonafÃ©, Franco P., Aradi, BÃ¡lint, Hourahine, Ben, Medrano, Carlos R., Hernandez, Federico J, Frauenheim, Thomas, Sanchez, Cristian G.

Journal:

Journal of Chemical Theory and Computation

Year:

2020

File:

PDF, 5.82 MB

2020

5

Platinum and gold dihydrides in silicon

B. Hourahine, R. Jones, S. Öberg, P.R. Briddon, T. Frauenheim

Journal:

Physica B: Condensed Matter

Year:

2003

Language:

english

File:

PDF, 211 KB

english, 2003

6

Hydrogen molecules and platelets in germanium

B. Hourahine, R. Jones, P.R. Briddon

Journal:

Physica B: Condensed Matter

Year:

2006

Language:

english

File:

PDF, 104 KB

english, 2006

7

A theoretical study of erbium in GaN

B. Hourahine, S. Sanna, B. Aradi, C. Köhler, T. Frauenheim

Journal:

Physica B: Condensed Matter

Year:

2006

Language:

english

File:

PDF, 139 KB

english, 2006

8

A theoretical study of O chemisorption on GaN (0 0 0 1)/(0 0 0 1̄) surfaces

J Elsner, R Gutierrez, B Hourahine, R Jones, M Haugk, Th Frauenheim

Journal:

Solid State Communications

Year:

1998

Language:

english

File:

PDF, 215 KB

english, 1998

9

Piezospectroscopic analysis of the hydrogen–carbon complexes in silicon

O Andersen, L Dobaczewski, A.R Peaker, K Bonde Nielsen, B Hourahine, R Jones, P.R Briddon, S Öberg

Journal:

Physica B: Condensed Matter

Year:

2001

Language:

english

File:

PDF, 108 KB

english, 2001

10

Evidence for H2∗ trapped by carbon impurities in silicon

B Hourahine, R Jones, S Öberg, P.R Briddon, V.P Markevich, R.C Newman, J Hermansson, M Kleverman, J.L Lindström, L.I Murin, N Fukata, M Suezawa

Journal:

Physica B: Condensed Matter

Year:

2001

Language:

english

File:

PDF, 120 KB

english, 2001

11

Optically active hydrogen dimers in silicon

B Hourahine, R Jones, A.N Safonov, S Öberg, P.R Briddon, S.K Estreicher

Journal:

Physica B: Condensed Matter

Year:

1999

Language:

english

File:

PDF, 158 KB

english, 1999

12

Molecular hydrogen traps within silicon

B. Hourahine, R. Jones, S. Öberg, P.R. Briddon

Journal:

Materials Science and Engineering: B

Year:

1999

Language:

english

File:

PDF, 61 KB

english, 1999

13

Global search for stable screw dislocation cores in III-N semiconductors

S. Kraeusel, B. Hourahine

Journal:

physica status solidi (a)

Year:

2012

Language:

english

File:

PDF, 252 KB

english, 2012

14

Simple models for InGaN alloys

Fathi Elfituri, Ben Hourahine

Journal:

physica status solidi (a)

Year:

2012

Language:

english

File:

PDF, 245 KB

english, 2012

15

Imaging and identifying defects in nitride semiconductor thin films using a scanning electron microscope

G. Naresh-Kumar, B. Hourahine, A. Vilalta-Clemente, P. Ruterana, P. Gamarra, C. Lacam, M. Tordjman, M. A. di Forte-Poisson, P. J. Parbrook, A. P. Day, G. England, C. Trager-Cowan

Journal:

physica status solidi (a)

Year:

2012

Language:

english

File:

PDF, 216 KB

english, 2012

16

Luminescence spectroscopy of Eu-implanted zincblende GaN

I. S. Roqan, K. P. O'Donnell, C. Trager-Cowan, B. Hourahine, R. W. Martin, K. Lorenz, E. Alves, D. J. As, M. Panfilova, I. M. Watson

Journal:

physica status solidi (b)

Year:

2008

Language:

english

File:

PDF, 189 KB

english, 2008

17

Theoretical study of rare earth point defects in GaN

Simone Sanna, B. Hourahine, Th. Frauenheim, U. Gerstmann

Journal:

physica status solidi (c)

Year:

2008

Language:

english

File:

PDF, 112 KB

english, 2008

18

p-type surface doping of diamond: a first-principles study

Goss, J P, Hourahine, B, Jones, R, Heggie, M I, Briddon, P R

Journal:

Journal of Physics Condensed Matter

Year:

2001

Language:

english

File:

PDF, 118 KB

english, 2001

19

Geometrical Mie theory for resonances in nanoparticles of any shape

Papoff, F., Hourahine, B.

Journal:

Year:

2011

Language:

english

File:

PDF, 6.93 MB

english, 2011

20

Treatment of Collinear and Noncollinear Electron Spin within an Approximate Density Functional Based Method †

Köhler, Christof, Frauenheim, Thomas, Hourahine, Ben, Seifert, Gotthard, Sternberg, Michael

Journal:

Journal of Physical Chemistry A

Year:

2007

Language:

english

File:

PDF, 126 KB

english, 2007

21

Electron channeling contrast imaging studies of nonpolar nitrides using a scanning electron microscope

Naresh-Kumar, G., Mauder, C., Wang, K. R., Kraeusel, S., Bruckbauer, J., Edwards, P. R., Hourahine, B., Kalisch, H., Vescan, A., Giesen, C., Heuken, M., Trampert, A., Day, A. P., Trager-Cowan, C.

Journal:

Applied Physics Letters

Year:

2013

Language:

english

File:

PDF, 1.04 MB

english, 2013

22

DFTB + and lanthanides

Hourahine, B, Aradi, B, Frauenheim, T

Journal:

Journal of Physics Conference Series

Year:

2010

Language:

english

File:

PDF, 498 KB

english, 2010

23

Self-Interaction and Strong Correlation in DFTB †

Hourahine, B., Sanna, S., Aradi, B., Köhler, C., Niehaus, Th., Frauenheim, Th.

Journal:

Journal of Physical Chemistry A

Year:

2007

Language:

english

File:

PDF, 100 KB

english, 2007

24

Initial Steps toward Automating the Fitting of DFTB E rep ( r ) †

Knaup, J. M., Hourahine, B., Frauenheim, Th.

Journal:

Journal of Physical Chemistry A

Year:

2007

Language:

english

File:

PDF, 102 KB

english, 2007

25

An Efficient LDA+ U Based Tight Binding Approach †

Sanna, Simone, Hourahine, B., Gallauner, Th., Frauenheim, Th.

Journal:

Journal of Physical Chemistry A

Year:

2007

Language:

english

File:

PDF, 285 KB

english, 2007

26

Coincident Electron Channeling and Cathodoluminescence Studies of Threading Dislocations in GaN

Naresh-Kumar, Gunasekar, Bruckbauer, Jochen, Edwards, Paul R., Kraeusel, Simon, Hourahine, Ben, Martin, Robert W., Kappers, Menno J., Moram, Michelle A., Lovelock, Stephen, Oliver, Rachel A., Humphrey

Journal:

Microscopy and Microanalysis

Year:

2014

Language:

english

File:

PDF, 292 KB

english, 2014

27

Anomalous Shift of the 1075 cm-1 Oxygen-Hydrogen Defect in Silicon

Hourahine, B., Jones, R., Öberg, Sven, Briddon, Patrick R.

Journal:

Materials Science Forum

Year:

1997

File:

PDF, 483 KB

1997

28

Formation of Helices in Graphene Nanoribbons under Torsion

Nikiforov, I., Hourahine, B., Frauenheim, Th., Dumitrică, T.

Journal:

The Journal of Physical Chemistry Letters

Year:

2014

Language:

english

File:

PDF, 1.04 MB

english, 2014

29

Plasmon modes in single gold nanodiscs

Imura, K., Ueno, K., Misawa, H., Okamoto, H., McArthur, D., Hourahine, B., Papoff, F.

Journal:

Year:

2014

Language:

english

File:

PDF, 3.45 MB

english, 2014

30

across the entire alloy composition range

Wang, K., O’Donnell, K. P., Hourahine, B., Martin, R. W., Watson, I. M., Lorenz, K., Alves, E.

Journal:

Physical Review B

Year:

2009

Language:

english

File:

PDF, 182 KB

english, 2009

31

Ewald summation on a helix: A route to self-consistent charge density-functional based tight-binding objective molecular dynamics

Nikiforov, I., Hourahine, B., Aradi, B., Frauenheim, Th., Dumitrică, T.

Journal:

The Journal of Chemical Physics

Year:

2013

Language:

english

File:

PDF, 841 KB

english, 2013

32

Weakly bound carbon-hydrogen complex in silicon

Hoffmann, L., Lavrov, E. V., Nielsen, B. Bech, Hourahine, B., Jones, R., Öberg, S., Briddon, P. R.

Journal:

Physical Review B

Year:

2000

Language:

english

File:

PDF, 132 KB

english, 2000

33

Electrical activity of carbon-hydrogen centers in Si

Andersen, O., Peaker, A. R., Dobaczewski, L., Nielsen, K. Bonde, Hourahine, B., Jones, R., Briddon, P. R., Öberg, S.

Journal:

Physical Review B

Year:

2002

Language:

english

File:

PDF, 121 KB

english, 2002

34

optical center

Hourahine, B., Jones, R., Safonov, A. N., Öberg, S., Briddon, P. R., Estreicher, S. K.

Journal:

Physical Review B

Year:

2000

Language:

english

File:

PDF, 346 KB

english, 2000

35

Local vibrational modes of two neighboring substitutional carbon atoms in silicon

Lavrov, E., Bech Nielsen, B., Byberg, J., Hourahine, B., Jones, R., Öberg, S., Briddon, P.

Journal:

Physical Review B

Year:

2000

Language:

english

File:

PDF, 112 KB

english, 2000

36

Efficient tight-binding approach for the study of strongly correlated systems

Sanna, Simone, Hourahine, B., Gerstmann, U., Frauenheim, Th.

Journal:

Physical Review B

Year:

2007

Language:

english

File:

PDF, 742 KB

english, 2007

37

Infrared activity of hydrogen molecules trapped in Si

Hourahine, B., Jones, R.

Journal:

Physical Review B

Year:

2003

Language:

english

File:

PDF, 370 KB

english, 2003

38

Rapid Nondestructive Analysis of Threading Dislocations in Wurtzite Materials Using the Scanning Electron Microscope

Naresh-Kumar, G., Hourahine, B., Edwards, P. R., Day, A. P., Winkelmann, A., Wilkinson, A. J., Parbrook, P. J., England, G., Trager-Cowan, C.

Journal:

Physical Review Letters

Year:

2012

Language:

english

File:

PDF, 995 KB

english, 2012

39

Hydrogen molecules in silicon located at interstitial sites and trapped in voids

Hourahine, B., Jones, R., Öberg, S., Newman, R. C., Briddon, P. R., Roduner, E.

Journal:

Physical Review B

Year:

1998

Language:

english

File:

PDF, 148 KB

english, 1998

40

Self-interstitial–hydrogen complexes in silicon

Hourahine, B., Jones, R., Öberg, S., Briddon, P. R.

Journal:

Physical Review B

Year:

1999

Language:

english

File:

PDF, 111 KB

english, 1999

41

[IEEE 2013 Conference on Lasers & Electro-Optics Europe & International Quantum Electronics Conference CLEO EUROPE/IQEC - Munich, Germany (2013.05.12-2013.05.16)] 2013 Conference on Lasers & Electro-Optics Europe & International Quantum Electronics Conference CLEO EUROPE/IQEC - Strong near field coupling and enhanced energy extraction in metal nanostructures

McArthur, D., Hourahine, B., Papoff, F.

Year:

2013

Language:

english

File:

PDF, 102 KB

english, 2013

42

Hydrogen-related photoluminescent centers in SiC

Prezzi, D., Eberlein, T. A. G., Jones, R., Hourahine, B., Briddon, P. R., Öberg, S.

Journal:

Physical Review B

Year:

2004

Language:

english

File:

PDF, 168 KB

english, 2004

43

[IEEE 2013 Conference on Lasers & Electro-Optics Europe & International Quantum Electronics Conference CLEO EUROPE/IQEC - Munich, Germany (2013.05.12-2013.05.16)] 2013 Conference on Lasers & Electro-Optics Europe & International Quantum Electronics Conference CLEO EUROPE/IQEC - Mode control of light scattering by nanoparticles

Hourahine, B., Papoff, F.

Year:

2013

Language:

english

File:

PDF, 232 KB

english, 2013

44

Defect evolution and interplay in n-type InN

Rauch, Christian, Tuomisto, Filip, Vilalta-Clemente, Arantxa, Lacroix, Bertrand, Ruterana, Pierre, Kraeusel, Simon, Hourahine, Ben, Schaff, William J.

Journal:

Applied Physics Letters

Year:

2012

Language:

english

File:

PDF, 586 KB

english, 2012

45

[IEEE 12th European Quantum Electronics Conference CLEO EUROPE/EQEC - Munich, Germany (2011.05.22-2011.05.26)] 2011 Conference on Lasers and Electro-Optics Europe and 12th European Quantum Electronics Conference (CLEO EUROPE/EQEC) - CLEO®/europe-EQEC 2009 electromagnetic resonances in nanoparticles of arbitrary shape

Papoff, F., Hourahine, B.

Year:

2011

Language:

english

File:

PDF, 180 KB

english, 2011

46

in germanium by Raman scattering and ab initio calculations

Hiller, M., Lavrov, E. V., Weber, J., Hourahine, B., Jones, R., Briddon, P. R.

Journal:

Physical Review B

Year:

2005

Language:

english

File:

PDF, 65 KB

english, 2005

47

Electronic behavior of rare-earth dopants in AlN: A density-functional study

Petit, S., Jones, R., Shaw, M. J., Briddon, P. R., Hourahine, B., Frauenheim, T.

Journal:

Physical Review B

Year:

2005

Language:

english

File:

PDF, 67 KB

english, 2005

48

Combined infrared absorption and modeling study of a dicarbon-dihydrogen defect in silicon

Lavrov, E. V., Hoffmann, L., Bech Nielsen, B., Hourahine, B., Jones, R., Öberg, S., Briddon, P. R.

Journal:

Physical Review B

Year:

2000

Language:

english

File:

PDF, 144 KB

english, 2000

49

The Interaction of Hydrogen with Deep Level Defects in Silicon

Jones, R., Coomer, B.J., Goss, J.P., Hourahine, B., Resende, A.

Journal:

Solid State Phenomena

Year:

2000

Language:

english

File:

PDF, 3.35 MB

english, 2000

50

Applications of electron channeling contrast imaging for characterizing nitride semiconductor thin films

Trager-Cowan, C., Naresh-Kumar, G., Hourahine, B., Edwards, P.R., Bruckbauer, J., Martin, R.W., Mauder, C., Day, A.P., England, G., Winkelmann, A., Parbrook, P.J., Wilkinson, A.

Journal:

Microscopy and Microanalysis

Year:

2012

Language:

english

File:

PDF, 449 KB

english, 2012

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