Dr. Marjan Krstic

  • Wolfgang-Gaede-Str. 1
    76131 Karlsruhe

Publications


2024
  1. Polarization-dependent effects in vibrational absorption spectra of 2D finite-size adsorbate islands on dielectric substrates
    Zerulla, B.; Krstić, M.; Chen, S.; Yu, Z.; Beutel, D.; Holzer, C.; Nyman, M.; Nefedov, A.; Wang, Y.; Mayerhöfer, T. G.; Wöll, C.; Rockstuhl, C.
    2024. Physical Chemistry Chemical Physics, 26 (18), 13683–13693. doi:10.1039/d4cp00860j
  2. Separating the Material and Geometry Contribution to the Circular Dichroism of Chiral Objects Made from Chiral Media
    Rebholz, L.; Krstić, M.; Zerulla, B.; Pawlak, M.; Lewandowski, W.; Fernandez-Corbaton, I.; Rockstuhl, C.
    2024. ACS Photonics, 11 (4), 1771–1779. doi:10.1021/acsphotonics.4c00205
  3. Multi‐Scale Modeling of Surface Second‐Harmonic Generation in Centrosymmetric Molecular Crystalline Materials: How Thick is the Surface?
    Zerulla, B.; Díaz, A. L.; Holzer, C.; Rockstuhl, C.; Fernandez-Corbaton, I.; Krstić, M.
    2024. Advanced Optical Materials, 2400150. doi:10.1002/adom.202400150
  4. Polarization-dependent effects in vibrational absorption spectra of 2D finite-size adsorbate islands on dielectric substrates
    Zerulla, B.; Krstić, M.; Chen, S.; Yu, Z.; Beutel, D.; Holzer, C.; Nyman, M.; Nefedov, A.; Wang, Y.; Mayerhöfer, T. G.; Wöll, C.; Rockstuhl, C.
    2024. doi:10.48550/arXiv.2403.00375
  5. A Digital Twin for a Chiral Sensing Platform
    Nyman, M.; Garcia-Santiago, X.; Krstić, M.; Materne, L.; Fernandez-Corbaton, I.; Holzer, C.; Scott, P.; Wegener, M.; Klopper, W.; Rockstuhl, C.
    2024. Laser & Photonics Reviews. doi:10.1002/lpor.202300967
  6. A Multi‐Scale Approach to Simulate the Nonlinear Optical Response of Molecular Nanomaterials
    Zerulla, B.; Beutel, D.; Holzer, C.; Fernandez-Corbaton, I.; Rockstuhl, C.; Krstić, M.
    2024. Advanced Materials, 36 (8), Art.-Nr.: 2311405. doi:10.1002/adma.202311405
2023
  1. How can (TD-)DFT improve multi-scale optical simulations of novel nano-materials and devices?
    Krstic, M.; Holzer, C.; Zerulla, B.; Beutel, D.; Li, C.; Heinke, L.; Woll, C.; Fernandez-Corbaton, I.; Rockstuhl, C.
    2023. CLEO: Science and Innovations : part of Conference on Lasers & Electro-Optics 2023, Optica Publishing Group (OSA)
  2. TURBOMOLE: Today and Tomorrow
    Franzke, Y. J.; Holzer, C. H.; Andersen, J. H.; Begušić, T.; Bruder, F.; Coriani, S.; Della Sala, F.; Fabiano, E.; Fedotov, D. A.; Fürst, S.; Gillhuber, S.; Grotjahn, R.; Kaupp, M.; Kehry, M.; Krstić, M.; Mack, F.; Majumdar, S.; Nguyen, B. D.; Parker, S. M.; Pauly, F.; Pausch, A.; Perlt, E.; Phun, G. S.; Rajabi, A.; Rappoport, D.; Samal, B.; Schrader, T.; Sharma, M.; Tapavicza, E.; Treß, R. S.; Voora, V.; Wodyński, A.; Yu, J. M.; Zerulla, B.; Furche, F.; Hättig, C.; Sierka, M.; Tew, D. P.; Weigend, F.
    2023. Journal of Chemical Theory and Computation, 19 (20), 6859–6890. doi:10.1021/acs.jctc.3c00347
  3. Exploring Functional Photonic Devices made from a Chiral Metal–Organic Framework Material by a Multiscale Computational Method
    Zerulla, B.; Li, C.; Beutel, D.; Oßwald, S.; Holzer, C.; Bürck, J.; Bräse, S.; Wöll, C.; Fernandez-Corbaton, I.; Heinke, L.; Rockstuhl, C.; Krstić, M.
    2023. Advanced Functional Materials. doi:10.1002/adfm.202301093
2022
  1. A T‐Matrix Based Approach to Homogenize Artificial Materials
    Zerulla, B.; Venkitakrishnan, R.; Beutel, D.; Krstić, M.; Holzer, C.; Rockstuhl, C.; Fernandez-Corbaton, I.
    2022. doi:10.48550/arXiv.2207.12228
  2. A T‐Matrix Based Approach to Homogenize Artificial Materials
    Zerulla, B.; Venkitakrishnan, R.; Beutel, D.; Krstić, M.; Holzer, C.; Rockstuhl, C.; Fernandez-Corbaton, I.
    2022. Advanced Optical Materials, 11 (3), Art.-Nr.: 2201564. doi:10.1002/adom.202201564
  3. Acenaphthenoannulation Induced by the Dual Lewis Acidity of Alumina
    Akhmetov, V.; Feofanov, M.; Ruppenstein, C.; Lange, J.; Sharapa, D.; Krstić, M.; Hampel, F.; Kataev, E. A.; Amsharov, K.
    2022. Chemistry - A European Journal, 28 (31), e202200584. doi:10.1002/chem.202200584
  4. A Multi-Scale Approach for Modeling the Optical Response of Molecular Materials Inside Cavities
    Zerulla, B.; Krstić, M.; Beutel, D.; Holzer, C.; Wöll, C.; Rockstuhl, C.; Fernandez-Corbaton, I.
    2022. Advanced Materials, 34 (21), Art.Nr. 2200350. doi:10.1002/adma.202200350
  5. The Adsorption of Small Molecules on the Copper Paddle-Wheel: Influence of the Multi-Reference Ground State
    Krstić, M.; Fink, K.; Sharapa, D. I.
    2022. Molecules, 27 (3), Art.-Nr.: 912. doi:10.3390/molecules27030912
2021
  1. Erratum: “Formation and desorption of nickel hexafluoroacetylacetonate Ni(hfac)2 on a nickel oxide surface in atomic layer etching processes” [J. Vac. Sci. Technol. A 38, 052602 (2020)]
    Basher, A. H.; Krstić, M.; Fink, K.; Ito, T.; Karahashi, K.; Wenzel, W.; Hamaguchi, S.
    2021. Journal of vacuum science & technology / A, 39 (5), Art.-Nr.: 057001. doi:10.1116/6.0001319
  2. Fluorescent Nanozeolite Receptors for the Highly Selective and Sensitive Detection of Neurotransmitters in Water and Biofluids
    Grimm, L. M.; Sinn, S.; Krstić, M.; D’Este, E.; Sonntag, I.; Prasetyanto, E. A.; Kuner, T.; Wenzel, W.; De Cola, L.; Biedermann, F.
    2021. Advanced Materials, 33 (49), Art.-Nr.: 2104614. doi:10.1002/adma.202104614
  3. Avoiding the Center-Symmetry Trap: Programmed Assembly of Dipolar Precursors into Porous, Crystalline Molecular Thin Films
    Nefedov, A.; Haldar, R.; Xu, Z.; Kühner, H.; Hofmann, D.; Goll, D.; Sapotta, B.; Hecht, S.; Krstić, M.; Rockstuhl, C.; Wenzel, W.; Bräse, S.; Tegeder, P.; Zojer, E.; Wöll, C.
    2021. Advanced Materials, 33 (35), Art.-Nr. 2103287. doi:10.1002/adma.202103287
  4. A coarse-grained xDLVO model for colloidal protein–protein interactions
    Pusara, S.; Yamin, P.; Wenzel, W.; Krstić, M.; Kozlowska, M.
    2021. Physical chemistry, chemical physics, 23 (22), 12780–12794. doi:10.1039/D1CP01573G
2020
  1. Boosting Light Emission from Single Hydrogen Phthalocyanine Molecules by Charging
    Rai, V.; Gerhard, L.; Sun, Q.; Holzer, C.; Repän, T.; Krstić, M.; Yang, L.; Wegener, M.; Rockstuhl, C.; Wulfhekel, W.
    2020. Nano letters, 20 (10), 7600–7605. doi:10.1021/acs.nanolett.0c03121
  2. Formation and desorption of nickel hexafluoroacetylacetonate Ni(hfac) on a nickel oxide surface in atomic layer etching processes
    Basher, A. H.; Krstić, M.; Fink, K.; Ito, T.; Karahashi, K.; Wenzel, W.; Hamaguchi, S.
    2020. Journal of vacuum science & technology / A, 38 (5), Art.Nr. 052602. doi:10.1116/6.0000293
  3. Stability of hexafluoroacetylacetone molecules on metallic and oxidized nickel surfaces in atomic-layer-etching processes
    Basher, A. H.; Krstić, M.; Takeuchi, T.; Isobe, M.; Ito, T.; Kiuchi, M.; Karahashi, K.; Wenzel, W.; Hamaguchi, S.
    2020. Journal of vacuum science & technology / A, 38 (2), Article: 022610. doi:10.1116/1.5127532
  4. Halogenated Terephthalic Acid "Antenna Effects" in Lanthanide-SURMOF Thin Films
    Santos, J. C. C.; Pramudya, Y.; Krstić, M.; Chen, D.-H.; Neumeier, B. L.; Feldmann, C.; Wenzel, W.; Redel, E.
    2020. ACS applied materials & interfaces, 12 (46), 52166–52174. doi:10.1021/acsami.0c15392
  5. The Interplay of Conformation and Electronic Structure in Metal Organic Frameworks
    Pramudya, Y.; Kozlowska, M.; Heidrich, S.; Krstić, M.; Haldar, R.; Neumann, T.; Schlöder, T.; Zhang, Q.; Symalla, F.; Hassan, Z. M.; Liu, X.; Heinke, L.; Wöll, C.; Wenzel, W.
    2020. ECS transactions, 98 (8), 3–13. doi:10.1149/09808.0003ecst
2019
  1. A de novo strategy for predictive crystal engineering to tune excitonic coupling
    Haldar, R.; Mazel, A.; Krstić, M.; Zhang, Q.; Jakoby, M.; Howard, I. A.; Richards, B. S.; Jung, N.; Jacquemin, D.; Diring, S.; Wenzel, W.; Odobel, F.; Wöll, C.
    2019. Nature Communications, 10 (1), Art.Nr. 2048. doi:10.1038/s41467-019-10011-8
2010
  1. Nonlinear PDE–based motion planning for the formation control of mobile agents
    Meurer, T.; Krstic, M.
    2010. IFAC Proceedings Volumes, 43 (14), 599–604. doi:10.3182/20100901-3-IT-2016.00072
  2. Further Results on Stabilization of Shock-Like Equilibria of the Viscous Burgers PDE
    Smyshlyaev, A.; Meurer, T.; Krstic, M.
    2010. IEEE Transactions on Automatic Control, 55 (8), 1942–1946. doi:10.1109/TAC.2010.2050018