Zobrazeno 1 - 10
of 425
pro vyhledávání: '"Blum V"'
Autor:
Sforzini, J., Nemec, L., Denig, T., Stadtmüller, B., Lee, T. -L., Kumpf, C., Soubatch, S., Starke, U., Rinke, P., Blum, V., Bocquet, F. C., Tautz, F. S.
Publikováno v:
Phys. Rev. Lett. 114, 106804 (2015)
We measure the adsorption height of hydrogen-intercalated quasi-free-standing monolayer graphene on the (0001) face of 6H silicon carbide by the normal incidence x-ray standing wave technique. A density functional calculation for the full ($6 \sqrt{3
Externí odkaz:
http://arxiv.org/abs/1411.4753
Autor:
Rossi, M., Blum, V., Kupser, P., von Helden, G., Bierau, F., Pagel, K., Meijer, G., Scheffler, M.
Publikováno v:
J. Phys. Chem. Lett., 2010, 1, pp 3465-3470
The polyalanine-based peptide series Ac-Ala_n-LysH+ (n=5-20) is a prime example that a secondary structure motif which is well-known from the solution phase (here: helices) can be formed in vacuo. We here revisit this conclusion for n=5,10,15, using
Externí odkaz:
http://arxiv.org/abs/1005.1228
Autor:
Todorova, M., Lundgren, E., Blum, V., Mikkelsen, A., Gray, S., Gustafson, J., Borg, M., Rogal, J., Reuter, K., Andersen, J. N., Scheffler, M.
Publikováno v:
Surf. Sci. 541, 101-112 (2003)
Combining high-resolution core-level spectroscopy (HRCLS), scanning tunneling microscopy (STM) and density-functional theory (DFT) calculations we reanalyze the Pd(100)-(SQRT(5) x SQRT(5) R27^o)-O surface oxide phase. We find that the prevalent struc
Externí odkaz:
http://arxiv.org/abs/cond-mat/0304107
Autor:
Reuter, K., Vamvakas, J. A., Saldin, D. K., Blum, V., Ott, M., Wedler, H., Doell, R., Heinz, K.
Following on the success of the recent application of holographic LEED to the determination of the 3D atomic geometry of Si adatoms on a SiC(111) p(3x3) surface, which enabled that structure to be solved, we show in this paper that a similar techniqu
Externí odkaz:
http://arxiv.org/abs/cond-mat/9803023
Akademický článek
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Autor:
Gavini, V., Baroni, S., Blum, V., Bowler, D., Buccheri, A., Chelikowsky, J., Das, S., Dawson, W., Delugas, P., Dogan, M., Draxl, C., Galli, G., Genovese, L., Giannozzi, P., Giantomassi, M., Gonze, X., Govoni, M., Gulans, A., Gygi, F., Herbert, J., Kokott, S., Kühne, T., Liou, K., Miyazaki, T., Motamarri, P., Nakata, A., Pask, J., Plessl, C., Ratcliff, L., Richard, R., Rossi, M., Schade, R., Scheffler, M., Schütt, O., Suryanarayana, P., Torrent, M., Truflandier, L., Windus, T., Xu, Q., Yu, V., Perez, D.
Electronic structure calculations have been instrumental in providing many important insights into a range of physical and chemical properties of various molecular and solid-state systems. Their importance to various fields, including materials scien
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=od______1874::183ead82e2ec390614052883740cf708
https://hdl.handle.net/21.11116/0000-000B-29BE-221.11116/0000-000B-29C0-E
https://hdl.handle.net/21.11116/0000-000B-29BE-221.11116/0000-000B-29C0-E
Autor:
Hourahine, B., Aradi, B., Blum, V., Bonafé, F., Buccheri, A., Camacho, C., Cevallos, C., Deshaye, M. Y., Dumitrică, T., Dominguez, A., Ehlert, S., Elstner, M., van der Heide, T., Hermann, J., Irle, S., Kranz, J. J., Köhler, C., Kowalczyk, T., Kubař, T., Lee, I. S.
Publikováno v:
Journal of Chemical Physics; 3/31/2020, Vol. 152 Issue 12, p1-19, 19p, 8 Graphs
Autor:
Moliner, L., Zellweger, N.M., Schmidt, S.M., Waibel, C., Froesch, P.R., Häuptle, P., Blum, V., Holer, L., Frueh, M., Bhagani, S., Gray, H-L.J., Cox, S., Khalid, T., Scott, D.C., Robinson, S.D., Hennah, L., Handforth, C., Mauti, L.A., Califano, R., Rothschild, S.I.
Publikováno v:
In Immuno-Oncology and Technology December 2022 16 Supplement 1
FHI-aims is a quantum mechanics software package based on numeric atom-centered orbitals (NAOs) with broad capabilities for all-electron electronic-structure calculations and ab initio molecular dynamics. It also connects to workflows for multi-scale
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=od______1874::2a1f2052bd48040ad05196191d262761
https://hdl.handle.net/21.11116/0000-000A-EAD3-021.11116/0000-000A-EAD5-E
https://hdl.handle.net/21.11116/0000-000A-EAD3-021.11116/0000-000A-EAD5-E
Akademický článek
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