• Kemitorvet, 206, 226

    2800 Kgs. Lyngby

    Denmark

20122020
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Research Output 2012 2020

  • 30 Journal article

Vibrational wavepacket dynamics in Fe carbene photosensitizer determined with femtosecond X-ray emission and scattering

Kunnus, K., Vacher, M., Harlang, T. C. B., Kjær, K. S., Haldrup, K., Biasin, E., van Driel, T. B., Pápai, M. I., Chabera, P., Liu, Y., Tatsuno, H., Timm, C., Källman, E., Delcey, M., Hartsock, R. W., Reinhard, M. E., Koroidov, S., Laursen, M., Hansen, F. B., Vester, P. & 21 others, Christensen, M., Sandberg, L., Németh, Z., Szemes, D. S., Bajnóczi, É., Alonso-Mori, R., Glownia, J. M., Nelson, S., Sikorski, M., Sokaras, D., Lemke, H. T., Canton, S. E., Braagaard Møller, K., Nielsen, M. M., Vankó, G., Wärnmark, K., Sundström, V., Persson, P., Lundberg, M., Uhlig, J. & Gaffney, K. J., 2020, In : Nature Communications. 11, 1, 11 p., 634.

Research output: Contribution to journalJournal articleResearchpeer-review

Open Access
File

Excited state dynamics initiated by an electromagnetic field within the Variational Multi-Configurational Gaussian (vMCG) method

Penfold, T. J., Pápai, M., Møller, K. B. & Worth, G. A., 2019, In : Computational and Theoretical Chemistry. 1160, p. 24-30 7 p.

Research output: Contribution to journalJournal articleResearchpeer-review

12 Downloads (Pure)
Open Access
File
82 Downloads (Pure)

Finding intersections between electronic excited state potential energy surfaces with simultaneous ultrafast X-ray scattering and spectroscopy

Kjær, K. S., Van Driel, T. B., Harlang, T. C. B., Kunnus, K., Biasin, E., Ledbetter, K., Hartsock, R. W., Reinhard, M. E., Koroidov, S., Li, L., Laursen, M. G., Hansen, F. B., Vester, P., Christensen, M., Haldrup, K., Nielsen, M. M., Dohn, A. O., Pápai, M. I., Møller, K. B., Chabera, P. & 20 others, Liu, Y., Tatsuno, H., Timm, C., Jarenmark, M., Uhlig, J., Sundstöm, V., Wärnmark, K., Persson, P., Németh, Z., Szemes, D. S., Bajnóczi, É., Vankó, G., Alonso-Mori, R., Glownia, J. M., Nelson, S., Sikorski, M., Sokaras, D., Canton, S. E., Lemke, H. T. & Gaffney, K. J., 2019, In : Chemical Science. 10, 22, p. 5749-5760 12 p.

Research output: Contribution to journalJournal articleResearchpeer-review

Open Access
File

Mechanism of Photoinduced Dihydroazulene Ring-Opening Reaction

Abedi, M., Pápai, M. I., Mikkelsen, K. V., Henriksen, N. E. & Møller, K. B., 2019, In : Journal of Physical Chemistry Letters. 10, p. 3944-3949 6 p.

Research output: Contribution to journalJournal articleResearchpeer-review

Projects 2016 2019

Atomistic Mechanisms of Functional Molecules

Abedi, M., Møller, K. B., Henriksen, N. E., Pápai, M. I., Coriani, S., Gonzalez, L. & Worth, G. M. A.

Samfinansieret - Andet

01/02/201604/11/2019

Project: PhD