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140 results on '"Gross, E.K.U."'

4. Molecules and clusters in strong laser fields

Author

Schulz, Claus Peter, Burnus, Tobias, Castro, Alberto, Gross, E.K.U., Heidenreich, Andreas, Hertel1, Ingolf V., Jortner, Joshua, Laarmann, Tim, Last, Isidore, Levis, Robert J., Marques, Miguel A. L., Romanov, Dmitri A., Saenz, Alejandro, Castleman, A.W., Jr., editor, Toennies, J.P., editor, Yamanouchi, K., editor, Zinth, W., editor, Kühn, Oliver, editor, and Wöste, Ludger, editor

Published
2007
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5. Time-Dependent Transport Through Single Molecules: Nonequilibrium Green’s Functions

Author

Stefanucci, G., Almbladh, C.-O., Kurth, S., Gross, E.K.U., Rubio, A., van Leeuwen, R., Dahlen, N.E., von Barth, U., Beig, R., editor, Beiglböck, W., editor, Domcke, W., editor, Englert, B.-G., editor, Frisch, U., editor, Hänggi, P., editor, Hasinger, G., editor, Hepp, K., editor, Hillebrandt, W., editor, Imboden, D., editor, Jaffe, R. L., editor, Lipowsky, R., editor, Löhneysen, H. v., editor, Ojima, I., editor, Sornette, D., editor, Theisen, S., editor, Weise, W., editor, Wess, J., editor, Zittartz, J., editor, Marques, Miguel A.L., editor, Ullrich, Carsten A., editor, Nogueira, Fernando, editor, Rubio, Angel, editor, Burke, Kieron, editor, and Gross, Eberhard K. U., editor

Published
2006
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6. Back to the Ground-State: Electron Gas

Author

Lein, M., Gross, E.K.U., Beig, R., editor, Beiglböck, W., editor, Domcke, W., editor, Englert, B.-G., editor, Frisch, U., editor, Hänggi, P., editor, Hasinger, G., editor, Hepp, K., editor, Hillebrandt, W., editor, Imboden, D., editor, Jaffe, R. L., editor, Lipowsky, R., editor, Löhneysen, H. v., editor, Ojima, I., editor, Sornette, D., editor, Theisen, S., editor, Weise, W., editor, Wess, J., editor, Zittartz, J., editor, Marques, Miguel A.L., editor, Ullrich, Carsten A., editor, Nogueira, Fernando, editor, Rubio, Angel, editor, Burke, Kieron, editor, and Gross, Eberhard K. U., editor

Published
2006
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7. Multicomponent Density-Functional Theory

Author

van Leeuwen, R., Gross, E.K.U., Beig, R., editor, Beiglböck, W., editor, Domcke, W., editor, Englert, B.-G., editor, Frisch, U., editor, Hänggi, P., editor, Hasinger, G., editor, Hepp, K., editor, Hillebrandt, W., editor, Imboden, D., editor, Jaffe, R. L., editor, Lipowsky, R., editor, Löhneysen, H. v., editor, Ojima, I., editor, Sornette, D., editor, Theisen, S., editor, Weise, W., editor, Wess, J., editor, Zittartz, J., editor, Marques, Miguel A.L., editor, Ullrich, Carsten A., editor, Nogueira, Fernando, editor, Rubio, Angel, editor, Burke, Kieron, editor, and Gross, Eberhard K. U., editor

Published
2006
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8. Basics

Author

Gross, E.K.U., Burke, K., Beig, R., editor, Beiglböck, W., editor, Domcke, W., editor, Englert, B.-G., editor, Frisch, U., editor, Hänggi, P., editor, Hasinger, G., editor, Hepp, K., editor, Hillebrandt, W., editor, Imboden, D., editor, Jaffe, R. L., editor, Lipowsky, R., editor, Löhneysen, H. v., editor, Ojima, I., editor, Sornette, D., editor, Theisen, S., editor, Weise, W., editor, Wess, J., editor, Zittartz, J., editor, Marques, Miguel A.L., editor, Ullrich, Carsten A., editor, Nogueira, Fernando, editor, Rubio, Angel, editor, Burke, Kieron, editor, and Gross, Eberhard K. U., editor

Published
2006
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10. The 2021 room-temperature superconductivity roadmap

Author

Física aplicada I, Fisika aplikatua I, Boeri, Lilia, Hennig, Richard, Hirschfeld, Peter, Profeta, Gianni, Sanna, Antonio, Zurek, Eva, Pickett, Warren E., Amsler, Maximilian, Dias, Ranga, Eremets, Mikhail I., Heil, Christoph, Hemley, Russell J., Liu, Hanyu, Ma, Yanming, Pierleoni, Carlo, Kolmogorov, Aleksey N., Rybin, Nikita, Dmitry, Novoselov, Anisimov, Vladimir, Oganov, Artem R., Pickard, Chris J., Bi, Tiange, Arita, Ryotaro, Errea Lope, Ion, Pellegrini, Camila, Requist, Ryan, Gross, E.K.U., Margine, Elena Roxana, Xie, Stephen R., Quan, Yundi, Hire, Ajinkya, Fanfarillo, Laura, Stewart, G. R., Hamlin, J. J., Stanev, Valentin, Gonnelli, Renato S., Piatti, Erik, Romanin, Davide, Daghero, Dario, Valenti, Roser, Física aplicada I, Fisika aplikatua I, Boeri, Lilia, Hennig, Richard, Hirschfeld, Peter, Profeta, Gianni, Sanna, Antonio, Zurek, Eva, Pickett, Warren E., Amsler, Maximilian, Dias, Ranga, Eremets, Mikhail I., Heil, Christoph, Hemley, Russell J., Liu, Hanyu, Ma, Yanming, Pierleoni, Carlo, Kolmogorov, Aleksey N., Rybin, Nikita, Dmitry, Novoselov, Anisimov, Vladimir, Oganov, Artem R., Pickard, Chris J., Bi, Tiange, Arita, Ryotaro, Errea Lope, Ion, Pellegrini, Camila, Requist, Ryan, Gross, E.K.U., Margine, Elena Roxana, Xie, Stephen R., Quan, Yundi, Hire, Ajinkya, Fanfarillo, Laura, Stewart, G. R., Hamlin, J. J., Stanev, Valentin, Gonnelli, Renato S., Piatti, Erik, Romanin, Davide, Daghero, Dario, and Valenti, Roser

Abstract

Designing materials with advanced functionalities is the main focus of contemporary solid-state physics and chemistry. Research efforts worldwide are funneled into a few high-end goals, one of the oldest, and most fascinating of which is the search for an ambient temperature superconductor (A-SC). The reason is clear: superconductivity at ambient conditions implies being able to handle, measure and access a single, coherent, macroscopic quantum mechanical state without the limitations associated with cryogenics and pressurization. This would not only open exciting avenues for fundamental research, but also pave the road for a wide range of technological applications, affecting strategic areas such as energy conservation and climate change. In this roadmap we have collected contributions from many of the main actors working on superconductivity, and asked them to share their personal viewpoint on the field. The hope is that this article will serve not only as an instantaneous picture of the status of research, but also as a true roadmap defining the main long-term theoretical and experimental challenges that lie ahead. Interestingly, although the current research in superconductor design is dominated by conventional (phonon-mediated) superconductors, there seems to be a widespread consensus that achieving A-SC may require different pairing mechanisms.

Published
2022

31. Reproducibility in density functional theory calculations of solids

Author

Lejaeghere, K., Bihlmayer, G., Bjorkman, T., Blaha, P., Blugel, S., Blum, V., Caliste, D., Castelli, I.E., Clark, S.J., Dal Corso, A., de Gironcoli, S., Deutsch, T., Dewhurst, J.K., Di Marco, I., Draxl, C., Dulak, M., Eriksson, O., Flores-Livas, J.A., Garrity, K.F., Genovese, L., Giannozzi, P., Giantomassi, M., Goedecker, S., Gonze, X., Granas, O., Gross, E.K.U., Gulans, A., Gygi, F., Hamann, D.R., Hasnip, P.J., Holzwarth, N.A.W., Iusan, D., Jochym, D.B., Jollet, F., Jones, Daniel, Kresse, G., Koepernik, K., Kucukbenli, E., Kvashnin, Y.O., Locht, I.L.M., Lubeck, S., Marsman, M., Marzari, N., Nitzsche, U., Nordstrom, L., Ozaki, T., Paulatto, L., Pickard, C.J., Poelmans, W., Probert, M.I.J., Refson, K., Richter, M., Rignanese, G.M., Saha, S., Scheffler, M., Schlipf, M., Schwarz, K., Sharma, Sangeeta, Tavazza, F., Thunstrom, P., Tkatchenko, A., Torrent, M., Vanderbilt, D., van Setten, M.J., Van Speybroeck, V., Wills, J.M., Yates, J.R., Zhang, G.X., Cottenier, S., Lejaeghere, K., Bihlmayer, G., Bjorkman, T., Blaha, P., Blugel, S., Blum, V., Caliste, D., Castelli, I.E., Clark, S.J., Dal Corso, A., de Gironcoli, S., Deutsch, T., Dewhurst, J.K., Di Marco, I., Draxl, C., Dulak, M., Eriksson, O., Flores-Livas, J.A., Garrity, K.F., Genovese, L., Giannozzi, P., Giantomassi, M., Goedecker, S., Gonze, X., Granas, O., Gross, E.K.U., Gulans, A., Gygi, F., Hamann, D.R., Hasnip, P.J., Holzwarth, N.A.W., Iusan, D., Jochym, D.B., Jollet, F., Jones, Daniel, Kresse, G., Koepernik, K., Kucukbenli, E., Kvashnin, Y.O., Locht, I.L.M., Lubeck, S., Marsman, M., Marzari, N., Nitzsche, U., Nordstrom, L., Ozaki, T., Paulatto, L., Pickard, C.J., Poelmans, W., Probert, M.I.J., Refson, K., Richter, M., Rignanese, G.M., Saha, S., Scheffler, M., Schlipf, M., Schwarz, K., Sharma, Sangeeta, Tavazza, F., Thunstrom, P., Tkatchenko, A., Torrent, M., Vanderbilt, D., van Setten, M.J., Van Speybroeck, V., Wills, J.M., Yates, J.R., Zhang, G.X., and Cottenier, S.

Abstract

Contains fulltext : 158675.pdf (Publisher’s version ) (Closed access)

Published
2016

32. Molecules and clusters in strong laser fields

Author

Schulz, Claus Peter, primary, Burnus, Tobias, additional, Castro, Alberto, additional, Gross, E.K.U., additional, Heidenreich, Andreas, additional, Hertel1, Ingolf V., additional, Jortner, Joshua, additional, Laarmann, Tim, additional, Last, Isidore, additional, Levis, Robert J., additional, Marques, Miguel A. L., additional, Romanov, Dmitri A., additional, and Saenz, Alejandro, additional

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36. First-principles approach to noncollinear magnetism: Towards spin dynamics

Author

Sharma, S., Dewhurst, J.K., Ambrosch-Draxl, C., Kurth, S., Helbig, N., Pittalis, S., Shallcross, Sam, Nordstrom, L., Gross, E.K.U., Sharma, S., Dewhurst, J.K., Ambrosch-Draxl, C., Kurth, S., Helbig, N., Pittalis, S., Shallcross, Sam, Nordstrom, L., and Gross, E.K.U.

Abstract

A description of noncollinear magnetism in the framework of spin-density functional theory is presented for the exact exchange energy functional which depends explicitly on two-component spinor orbitals. The equations for the effective Kohn-Sham scalar potential and magnetic field are derived within the optimized effective potential (OEP) framework. With the example of a magnetically frustrated Cr monolayer it is shown that the resulting magnetization density exhibits much more noncollinear structure than standard calculations. Furthermore, a time-dependent generalization of the noncollinear OEP method is well suited for an ab initio description of spin dynamics. We also show that the magnetic moments of solids Fe, Co, and Ni are well reproduced.

Published
2007

37. Comparison of exact-exchange calculations for solids in current-spin-density- and spin-density-functional theory

Author

Sharma, S., Pittalis, S., Kurth, S., Shallcross, Sam, Dewhurst, J.K., Gross, E.K.U., Sharma, S., Pittalis, S., Kurth, S., Shallcross, Sam, Dewhurst, J.K., and Gross, E.K.U.

Abstract

The relative merits of current-spin-density- and spin-density-functional theory are investigated for solids treated within the exact-exchange-only approximation. Spin-orbit splittings and orbital magnetic moments are determined at zero external magnetic field. We find that for magnetic (Fe, Co, and Ni) and nonmagnetic (Si and Ge) solids, the exact-exchange current-spin-density functional approach does not significantly improve the accuracy of the corresponding spin-density functional results.

Published
2007

41. Superconducting properties of MgB2 from first principles

Author

Floris, A., primary, Sanna, A., additional, Lüders, M., additional, Profeta, G., additional, Lathiotakis, N.N., additional, Marques, M.A.L., additional, Franchini, C., additional, Gross, E.K.U., additional, Continenza, A., additional, and Massidda, S., additional

Published
2007
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43. Molecules and clusters in strong laser fields.

Author

Castleman, A.W., Toennies, J.P., Yamanouchi, K., Zinth, W., Kühn, Oliver, Wöste, Ludger, Schulz, Claus Peter, Burnus, Tobias, Castro, Alberto, Gross, E.K.U., Heidenreich, Andreas, Hertel1, Ingolf V., Jortner, Joshua, Laarmann, Tim, Last, Isidore, Levis, Robert J., Marques, Miguel A. L., Romanov, Dmitri A., and Saenz, Alejandro

Abstract

In light matter interaction a ‘strong' laser field will be defined differently depending on the process under investigation. In the context of this chapter a laser field is considered to be strong if the potential energy surfaces of the irradiated molecule or cluster are altered considerably. [ABSTRACT FROM AUTHOR]

Published
2007
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