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2000


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Critical behaviour of V2H in a defective near-surface skin layer

Trenkler, J., Moss, S. C., Reichert, H., Paniago, R., Gebhardt, U., Carstanjen, H. D., Metzger, T. H., Peisl, J.

In Exploration of Subsurface Phenomena by Particle Scattering, pages: 155-164, International Advanced Studies Institute IASI Press, North East/MD, 2000 (incollection)

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[BibTex]

2000


[BibTex]


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Spectral distribution of activation energies in YBa2Cu3O7-δthin films

Warthmann, R., Albrecht, J., Kronmüller, H., Joos, C.

{Physical Review B}, 62, pages: 15226-15229, 2000 (article)

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[BibTex]

[BibTex]


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Ab-initio calculation of the formation and migration energies for Monovacancies in Mg

Krimmel, H., Fähnle, M.

{Physical Review B}, 62, pages: 5489-5491, 2000 (article)

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[BibTex]

[BibTex]


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Investigation of strain softening of icosahedral AlPdMn single quasicrystals

Brunner, D., Plachke, D., Carstanjen, H. D.

{Physica Status Solidi (A)}, 177, pages: 203-217, 2000 (article)

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[BibTex]

[BibTex]


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Formation and evolution of the transverse anisotropy with nanocrystallization in amorphous Fe73.5CuNb3Si13.5B9 ribbons

Guo, H. Q., Kronmüller, H., Dragon, T., Cheng, Z. H., Shen, B. G.

{Physical Review}, 62, pages: 5760-5764, 2000 (article)

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[BibTex]

[BibTex]


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Deflection of 32.8 TeV/c fully stripped Pb ions by means of a bent Si crystal

Biino, C., Clement, M., Doble, N., Elsener, K., Gatignon, L., Grafström, P., Herr, W., Keppler, P., Major, J., Mikkelsen, U., Taratin, A., Velasco, M.

{Nuclear Instruments and Methods in Physics Research B}, 160, pages: 536-543, 2000 (article)

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[BibTex]

[BibTex]


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Replacing muons by protons: polarized beam NMR

Schüth, J., Eversheim, P.-D., Herzog, P., Maier, K., Majer, G., Meyer, P., Roduner, E.

{Physica B}, 289-290, pages: 672-675, 2000 (article)

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[BibTex]

[BibTex]


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Charge transport mechanisms in single crystalline yttrium iron garnet as resolved by magnetic relaxation

Walz, F., Torres, L., Iñiguez, J., Kronmüller, H.

{Physica Status Solidi (A)}, 180, pages: 507-522, 2000 (article)

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[BibTex]

[BibTex]


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Theory of self-diffusion in alkali metals I. Results for monovacancies in Li, Na, and K

Schott, V., Fähnle, M., Madden, P. A.

{Journal of Physics: Condensed Matter}, 12, pages: 1171-1194, 2000 (article)

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[BibTex]

[BibTex]


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Theory of self-diffusion in alkali metals II. The influence of divacancies in Li

Schott, V., Fähnle, M., Madden, P. A.

{Journal of Physics: Condensed Matter}, 12, pages: 1195-1198, 2000 (article)

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[BibTex]

[BibTex]


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Decay kinetics of nonequilibrium Al-Si solid solutions

Sluchanko, N. E., Glushkov, V. V., Demishev, S. V., Kondrin, M. V., Ischenko, T. V., Gust, W., Brazhkin, V. V., Straumal, B. B., Bruynseraede, Y., Moshchalkov, V. V.

{Physical Review B}, 61, pages: 6019-6027, 2000 (article)

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[BibTex]

[BibTex]


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Vacuum arc deposition of Ti coatings

Straumal, B., Gust, W., Vershinin, N., Dimitriou, R., Rabkin, E.

{Surface and Coatings Technology}, 125, pages: 157-160, 2000 (article)

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[BibTex]

[BibTex]


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Internal friction in Ni-rich B2-NiAl

Brossmann, U., Hirscher, M., Schaible, D., Kronmüller, H.

{Scripta Materialia}, 42, pages: 1193-1197, 2000 (article)

mms

[BibTex]

[BibTex]


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Spectral distribution of activation energies in YBa2Cu3O7-δthin films

Warthmann, R., Albrecht, J., Kronmüller, H., Joos, C.

{Physical Review B}, 62, pages: 15226-15229, 2000 (article)

mms

[BibTex]

[BibTex]


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Pre-treatment of large area strips with the aid of a high power hall current accelerator

Vershinin, N., Dimitriou, R., Benmalek, M., Straumal, B., Gust, W., Vivas, J., Shulga, J.

{Surface and Coatings Technology}, 125, pages: 35-39, 2000 (article)

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[BibTex]

[BibTex]

1998


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Surface second-order nonlinear optical activity

Fischer, P., Buckingham, A.

JOURNAL OF THE OPTICAL SOCIETY OF AMERICA B-OPTICAL PHYSICS, 15(12):2951-2957, 1998 (article)

Abstract
Following the recent observation of a large second-harmonic intensity difference from a monolayer of chiral molecules with left and right circularly polarized light, the scattering theory is generalized and extended to predict linear and circular intensity differences for the more Versatile sum-frequency spectroscopy. Estimates indicate that intensity differences should be detectable for a typical experimental arrangement. The second-order nonlinear surface susceptibility tensor is given for different surface point groups in the electric dipole approximation; it is shown that nonlinear optical activity phenomena unambiguously probe molecular chirality only for molecular monolayers that are symmetric about the normal. Other surface symmetries can give rise to intensity differences from monolayers composed of achiral molecules. A water surface is predicted to show Linear and nonlinear optical activity in the presence of an electric field parallel to the surface. (C) 1998 Optical Society of America {[}S0740-3224(98)01311-3] OCIS codes: 190.0190, 190.4350, 240.6490.

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DOI [BibTex]

1998


DOI [BibTex]


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Linear electro-optic effect in optically active liquids

Buckingham, A., Fischer, P.

CHEMICAL PHYSICS LETTERS, 297(3-4):239-246, 1998 (article)

Abstract
A linear effect of an electrostatic field F on the intensity of sum- and difference-frequency generation in a chiral liquid is predicted. It arises in the electric dipole approximation. The effect changes sign with the enantiomer and on reversing the direction of the electrostatic field. The sum-frequency generator chi(alpha beta gamma)((2)) (-omega(3);omega(1),omega(2)), where omega(3) = omega(1) + omega(2), and the electric field-induced sum-frequency generator chi(alpha beta gamma delta)((3))(-omega(3);omega(1),omega(2),0)F-delta interfere and their contributions to the scattering power can be distinguished. Encouraging predictions are given for a typical experimental arrangement. (C) 1998 Elsevier Science B.V. All rights reserved.

pf

DOI [BibTex]

DOI [BibTex]


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Monolayers of hexadecyltrimethylammonium p-tosylate at the air-water interface. 1. Sum-frequency spectroscopy

Bell, G., Li, Z., Bain, C., Fischer, P., Duffy, D.

JOURNAL OF PHYSICAL CHEMISTRY B, 102(47):9461-9472, 1998 (article)

Abstract
Sum-frequency vibrational spectroscopy has been used to determine the structure of monolayers of the cationic surfactant, hexadecyltrimethylammonium p-tosylate (C(16)TA(+)Ts(-)), at the surface of water. Selective deuteration of the cation or the anion allowed the separate detection of sum-frequency spectra of the surfactant and of counterions that are bound to the monolayer. The p-tosylate ions an oriented with their methyl groups pointing away from the aqueous subphase and with the C-2 axis tilted, on average, by 30-40 degrees from the surface normal. The vibrational spectra of C(16)TA(+) indicate that the number of gauche defects in the monolayer does not change dramatically when bromide counterions are replaced by p-tosylate. The ends of the hydrocarbon chains of C16TA+ are, however, tilted much further from the surface normal in the presence of p-tosylate than in the presence of bromide. A quantitative analysis of the sum-frequency spectra requires a knowledge of the molecular hyperpolarizability tensor: the role of ab initio calculations and Raman spectroscopy in determining the components of this tensor is discussed.

pf

DOI [BibTex]

DOI [BibTex]


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Ultraviolet resonance Raman study of drug binding in dihydrofolate reductase, gyrase, and catechol O-methyltransferase

Couling, V., Fischer, P., Klenerman, D., Huber, W.

BIOPHYSICAL JOURNAL, 75(2):1097-1106, 1998 (article)

Abstract
This paper presents a study of the use of ultraviolet resonance Raman (UVRR) spectroscopic methods as a means of elucidating aspects of drug-protein interactions. Some of the RR vibrational bands of the aromatic amino acids tyrosine and tryptophan are sensitive to the microenvironment, and the use of UV excitation radiation allows selective enhancement of the spectral features of the aromatic amino acids, enabling observation specifically of their change in microenvironment upon drug binding. The three drug-protein systems investigated in this study are dihydrofolate reductase with its inhibitor trimethoprim, gyrase with novobiocin, and catechol O-methyltransferase with dinitrocatechol. It is demonstrated that UVRR spectroscopy has adequate sensitivity to be a useful means of detecting drug-protein interactions in those systems for which the electronic absorption of the aromatic amino acids changes because of hydrogen bonding and/or possible dipole-dipole and dipole-polarizability interactions with the ligand.

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DOI [BibTex]

DOI [BibTex]


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Geometric Image Synthesis

Alhaija, H. A., Mustikovela, S. K., Geiger, A., Rother, C.

(conference)

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Project Page [BibTex]


Project Page [BibTex]


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textes
(article)

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[BibTex]

[BibTex]