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Results: 1-25 | 26-50 | 51-75 | 76-78
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Authors: Staab, TEM Nieminen, RM Gebauer, J Krause-Rehberg, R Luysberg, M Haugk, M Frauenheim, T
Citation: Tem. Staab et al., Do arsenic interstitials really exist in As-rich GaAs? art. no. 045504, PHYS REV L, 8704(4), 2001, pp. 5504

Authors: Kim, E Chen, CF Kohler, T Elstner, M Frauenheim, T
Citation: E. Kim et al., Tetragonal crystalline carbon nitrides: Theoretical predictions, PHYS REV L, 86(4), 2001, pp. 652-655

Authors: Hasche, T Canzler, TW Scholz, R Hoffmann, M Schmidt, K Frauenheim, T Leo, K
Citation: T. Hasche et al., Coherent external and internal phonons in quasi-one-dimensional organic molecular crystals, PHYS REV L, 86(18), 2001, pp. 4060-4063

Authors: Elstner, M Hobza, P Frauenheim, T Suhai, S Kaxiras, E
Citation: M. Elstner et al., Hydrogen bonding and stacking interactions of nucleic acid base pairs: A density-functional-theory based treatment, J CHEM PHYS, 114(12), 2001, pp. 5149-5155

Authors: Lee, SM An, KH Lee, YH Seifert, G Frauenheim, T
Citation: Sm. Lee et al., A hydrogen storage mechanism in single-walled carbon nanotubes, J AM CHEM S, 123(21), 2001, pp. 5059-5063

Authors: Kaukonen, M Perajoki, J Nieminen, RM Jungnickel, G Frauenheim, T
Citation: M. Kaukonen et al., Locally activated Monte Carlo method for long-time-scale simulations, PHYS REV B, 61(2), 2000, pp. 980-987

Authors: Elsner, J Blumenau, AT Frauenheim, T Jones, R Heggie, MI
Citation: J. Elsner et al., Structural and electronic properties of line defects in GaN, MRS I J N S, 5, 2000, pp. NIL_413-NIL_423

Authors: Leipner, HS Hubner, CG Staab, TEM Haugk, M Sieck, A Krause-Rehberg, R Frauenheim, T
Citation: Hs. Leipner et al., Vacancy clusters in plastically deformed semiconductors, J PHYS-COND, 12(49), 2000, pp. 10071-10078

Authors: Blumenau, AT Jones, R Oberg, S Frauenheim, T Briddon, PR
Citation: At. Blumenau et al., Optical bands related to dislocations in Si, J PHYS-COND, 12(49), 2000, pp. 10123-10129

Authors: Blumenau, AT Elsner, J Jones, R Heggie, MI Oberg, S Frauenheim, T Briddon, PR
Citation: At. Blumenau et al., Dislocations in hexagonal and cubic GaN, J PHYS-COND, 12(49), 2000, pp. 10223-10233

Authors: Lee, SM Park, KS Choi, YC Park, YS Bok, JM Bae, DJ Nahm, KS Choi, YG Yu, SC Kim, NG Frauenheim, T Lee, YH
Citation: Sm. Lee et al., Hydrogen adsorption and storage in carbon nanotubes, SYNTH METAL, 113(3), 2000, pp. 209-216

Authors: Seifert, G Frauenheim, T
Citation: G. Seifert et T. Frauenheim, On the stability of non carbon nanotubes, J KOR PHYS, 37(2), 2000, pp. 89-92

Authors: Scholz, R Kobitski, AY Kampen, TU Schreiber, M Zahn, DRT Jungnickel, G Frauenheim, T
Citation: R. Scholz et al., Resonant Raman spectroscopy of organic semiconductors, PHYS ST S-B, 221(1), 2000, pp. 541-544

Authors: Rauls, E Lingner, T Hajnal, Z Greulich-Weber, S Frauenheim, T Spaeth, JM
Citation: E. Rauls et al., Metastability of the neutral silicon vacancy in 4H-SiC, PHYS ST S-B, 217(2), 2000, pp. R1-R3

Authors: Deak, P Frauenheim, T Pederson, MR
Citation: P. Deak et al., Computer simulation of materials at atomic level - Preface, PHYS ST S-B, 217(1), 2000, pp. 5-7

Authors: Frauenheim, T Seifert, G Elstner, M Hajnal, Z Jungnickel, G Porezag, D Suhai, S Scholz, R
Citation: T. Frauenheim et al., A self-consistent charge density-functional based tight-binding method forpredictive materials simulations in physics, chemistry and biology, PHYS ST S-B, 217(1), 2000, pp. 41-62

Authors: Elstner, M Frauenheim, T Kaxiras, E Seifert, G Suhai, S
Citation: M. Elstner et al., A self-consistent charge density-functional based tight-binding scheme forlarge biomolecules, PHYS ST S-B, 217(1), 2000, pp. 357-376

Authors: Haugk, M Elsner, J Frauenheim, T Staab, TEM Latham, CD Jones, R Leipner, HS Heine, T Seifert, G Sternberg, M
Citation: M. Haugk et al., Structures, energetics and electronic properties of complex III-V semiconductor systems, PHYS ST S-B, 217(1), 2000, pp. 473-511

Authors: Della Sala, F Widany, J Frauenheim, T
Citation: F. Della Sala et al., Comparison of simulation methods for organic molecular systems: Porphyrin stacks, PHYS ST S-B, 217(1), 2000, pp. 565-575

Authors: Elstner, M Jalkanen, KJ Knapp-Mohammady, M Frauenheim, T Suhai, S
Citation: M. Elstner et al., DFT studies on helix formation in N-acetyl-(L-alanyl)(n)-N '-methylamide for n=1-20, CHEM PHYS, 256(1), 2000, pp. 15-27

Authors: Lee, SM Belkhir, MA Zhu, XY Lee, YH Hwang, YG Frauenheim, T
Citation: Sm. Lee et al., Electronic structures of GaN edge dislocations, PHYS REV B, 61(23), 2000, pp. 16033-16039

Authors: Scholz, R Kobitski, AY Kampen, TU Schreiber, M Zahn, DRT Jungnickel, G Elstner, M Sternberg, M Frauenheim, T
Citation: R. Scholz et al., Resonant Raman spectroscopy of 3,4,9,10-perylene-tetracarboxylic-dianhydride epitaxial films, PHYS REV B, 61(20), 2000, pp. 13659-13669

Authors: Seifert, G Terrones, H Terrones, M Frauenheim, T
Citation: G. Seifert et al., Novel NbS2 metallic nanotubes, SOL ST COMM, 115(12), 2000, pp. 635-638

Authors: Seifert, G Terrones, H Terrones, M Jungnickel, G Frauenheim, T
Citation: G. Seifert et al., On the electronic structure of WS2 nanotubes, SOL ST COMM, 114(5), 2000, pp. 245-248

Authors: Rata, I Shvartsburg, AA Horoi, M Frauenheim, T Siu, KWM Jackson, KA
Citation: I. Rata et al., Single-parent evolution algorithm and the optimization of Si clusters, PHYS REV L, 85(3), 2000, pp. 546-549
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