Authors:
KRAUSE M
DUNSCH L
SEIFERT G
FOWLER PW
GROMOV A
KRATSCHMER W
GUTIEREZ R
POREZAG D
FRAUENHEIM T
Citation: M. Krause et al., VIBRATIONAL SIGNATURES OF FULLERENE OXIDES, Journal of the Chemical Society. Faraday transactions (Print), 94(16), 1998, pp. 2287-2294
Authors:
HAUGK M
ELSNER J
STERNBERG M
FRAUENHEIM T
Citation: M. Haugk et al., STRUCTURAL MODELS FOR THE ROOT-19X-ROOT-19 RECONSTRUCTION OF THE GAAS((1)OVER-BAR(1)OVER-BAR(1)OVER-BAR) SURFACE AND THEIR RELATIVE STABILITIES, Journal of physics. Condensed matter, 10(21), 1998, pp. 4523-4532
Authors:
FRAUENHEIM T
JUNGNICKEL G
SITCH P
KAUKONEN M
WEICH F
WIDANY J
POREZAG D
Citation: T. Frauenheim et al., A MOLECULAR-DYNAMICS STUDY OF N-INCORPORATION INTO CARBON SYSTEMS - DOPING, DIAMOND GROWTH AND NITRIDE FORMATION, DIAMOND AND RELATED MATERIALS, 7(2-5), 1998, pp. 348-355
Authors:
BOYD KJ
MARTON D
RABALAIS JW
UHLMANN S
FRAUENHEIM T
Citation: Kj. Boyd et al., SEMIQUANTITATIVE SUBPLANTATION MODEL FOR LOW-ENERGY ION INTERACTIONS WITH SURFACES - I - NOBLE-GAS ION-SURFACE INTERACTIONS, Journal of vacuum science & technology. A. Vacuum, surfaces, and films, 16(2), 1998, pp. 444-454
Authors:
BOYD KJ
MARTON D
RABALAIS JW
UHLMANN S
FRAUENHEIM T
Citation: Kj. Boyd et al., SEMIQUANTITATIVE SUBPLANTATION MODEL FOR LOW-ENERGY ION INTERACTIONS WITH SOLID-SURFACES - III - ION-BEAM HOMOEPITAXY OF SI, Journal of vacuum science & technology. A. Vacuum, surfaces, and films, 16(2), 1998, pp. 463-471
Authors:
ELSTNER M
POREZAG D
JUNGNICKEL G
ELSNER J
HAUGK M
FRAUENHEIM T
SUHAI S
SEIFERT G
Citation: M. Elstner et al., SELF-CONSISTENT-CHARGE DENSITY-FUNCTIONAL TIGHT-BINDING METHOD FOR SIMULATIONS OF COMPLEX MATERIALS PROPERTIES, Physical review. B, Condensed matter, 58(11), 1998, pp. 7260-7268
Authors:
KAUKONEN M
SITCH PK
JUNGNICKEL G
NIEMINEN RM
POYKKO S
POREZAG D
FRAUENHEIM T
Citation: M. Kaukonen et al., EFFECT OF N AND B DOPING ON THE GROWTH OF CVD DIAMOND (100)-H(2X1) SURFACES, Physical review. B, Condensed matter, 57(16), 1998, pp. 9965-9970
Authors:
HAJNAL Z
DEAK P
KOHLER T
KASCHNER R
FRAUENHEIM T
Citation: Z. Hajnal et al., THEORETICAL-STUDY OF THE LUMINESCENT SUBSTOICHIOMETRIC SILICON-OXIDES(SIOX), Solid state communications, 108(2), 1998, pp. 93-97
Authors:
ELSNER J
HAUGK M
JUNGNICKEL G
FRAUENHEIM T
Citation: J. Elsner et al., THEORY OF GA, N AND H TERMINATED GAN(0001) (000(1)OVER-BAR) SURFACES/, Solid state communications, 106(11), 1998, pp. 739-743
Citation: S. Uhlmann et al., MOLECULAR-DYNAMICS STUDY OF THE FUNDAMENTAL PROCESSES INVOLVED IN SUBPLANTATION OF DIAMOND-LIKE CARBON, Physical review letters, 81(3), 1998, pp. 641-644
Authors:
SITCH PK
JUNGNICKEL G
KAUKONEN M
POREZAG D
FRAUENHEIM T
PEDERSON MR
JACKSON KA
Citation: Pk. Sitch et al., A STUDY OF SUBSTITUTIONAL NITROGEN IMPURITIES IN CHEMICAL-VAPOR-DEPOSITED DIAMOND, Journal of applied physics, 83(9), 1998, pp. 4642-4646
Citation: M. Haugk et al., A DENSITY-FUNCTIONAL BASED TIGHT-BINDING APPROACH TO GAAS SURFACE RECONSTRUCTIONS, Journal of physics. Condensed matter, 9(35), 1997, pp. 7305-7315
Authors:
POREZAG D
JUNGNICKEL G
FRAUENHEIM T
SEIFERT G
AYUELA A
PEDERSON MR
Citation: D. Porezag et al., THEORETICAL INVESTIGATIONS OF HOMONUCLEAR AND HETERONUCLEAR BRIDGED FULLERENE OLIGOMERS, Applied physics A: Materials science & processing, 64(3), 1997, pp. 321-326
Citation: M. Sternberg et al., MOLECULAR-DYNAMICS STUDY OF DIAMOND SILICON(001) INTERFACES WITH AND WITHOUT GRAPHITIC INTERFACE LAYERS/, Physical review. B, Condensed matter, 56(3), 1997, pp. 1568-1580
Authors:
JACKSON K
PEDERSON MR
POREZAG D
HAJNAL Z
FRAUENHEIM T
Citation: K. Jackson et al., DENSITY-FUNCTIONAL-BASED PREDICTIONS OF RAMAN AND IR-SPECTRA FOR SMALL SI CLUSTERS, Physical review. B, Condensed matter, 55(4), 1997, pp. 2549-2555
Authors:
STERNBERG M
FRAUENHEIM T
ZIMMERMANNEDLING W
BUSMANN HG
Citation: M. Sternberg et al., STM IMAGES FROM DIAMOND SURFACES - STEPS TOWARDS COMPARISONS OF EXPERIMENT AND THEORY, Surface science, 370(2-3), 1997, pp. 232-244
Authors:
SEIFERT G
FOWLER PW
MITCHELL D
POREZAG D
FRAUENHEIM T
Citation: G. Seifert et al., BORON-NITROGEN ANALOGS OF THE FULLERENES - ELECTRONIC AND STRUCTURAL-PROPERTIES, Chemical physics letters, 268(5-6), 1997, pp. 352-358