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Research Zernike (ZIAM) Theory of Condensed Matter Jansen Group

Publications

2024

Baiz, C., Bredenbeck, J., Cho, M., Jansen, T., Krummel, A., & Roberts, S. (2024). Celebrating 25 years of 2D IR spectroscopy. Journal of Chemical Physics, 160(1), Article 010401. https://doi.org/10.1063/5.0190809
Soh, J. H., Jansen, T. L. C., & Palacino-González, E. (2024). Controlling the nonadiabatic dynamics of the charge-transfer process with chirped pulses: Insights from a double-pump time-resolved fluorescence spectroscopy scheme. Journal of Chemical Physics, 160(2), Article 024110. https://doi.org/10.1063/5.0177073
Paz Neme, N., Jansen, T. L. C., & Havenith, R. (2024). Cyclopentene ring effects in cyanine dyes: A handle to fine-tune photophysical properties. PCCP : Physical Chemistry Chemical Physics, 26(7), Article 6235. https://doi.org/10.1039/d3cp05219b
Nguyen, H. L., Do, T. N., Zhong, K., Akhtar, P., Jansen, T. L. C., Knoester, J., Caffarri, S., Lambrev, P., & Tan, H. S. (2024). Inter-subunit energy transfer processes in a minimal plant photosystem II supercomplex. Science Advances, 10(8), Article eadh0911. https://doi.org/10.1126/sciadv.adh0911

2023

Zhong, K., Nguyen, H. L., Do, T. N., Tan, H. S., Knoester, J., & Jansen, T. L. C. (2023). An efficient time-domain implementation of the multichromophoric Förster resonant energy transfer method. Journal of Chemical Physics, 158(6), 1710–1722. https://doi.org/10.1063/5.0136652
Erić, V., Li, X., Dsouza, L., Frehan, S. K., Huijser, A., Holzwarth, A. R., Buda, F., Sevink, G. J. A., de Groot, H. J. M., & Jansen, T. L. C. (2023). Manifestation of Hydrogen Bonding and Exciton Delocalization on the Absorption and Two-Dimensional Electronic Spectra of Chlorosomes. Journal of Physical Chemistry B, 127(5), 1097-1109. https://doi.org/10.1021/acs.jpcb.2c07143
Palacino-González, E., & Jansen, T. L. C. (2023). Modeling the Effect of Disorder in the Two-Dimensional Electronic Spectroscopy of Poly-3-hexyltiophene in an Organic Photovoltaic Blend: A Combined Quantum/Classical Approach. Journal of Physical Chemistry C, 127(14), 6793-6801. https://doi.org/10.1021/acs.jpcc.3c01080
Frehan, S. K., Dsouza, L., Li, X., Eríc, V., Jansen, T. L. C., Mul, G., Holzwarth, A. R., Buda, F., Sevink, G. J. A., de Groot, H. J. M., & Huijser, A. (2023). Photon Energy-Dependent Ultrafast Exciton Transfer in Chlorosomes of Chlorobium tepidum and the Role of Supramolecular Dynamics. Journal of Physical Chemistry B, 127(35), 7581-7589. https://doi.org/10.1021/acs.jpcb.3c05282
Van Hengel, C. D. N., Van Adrichem, K. E., & Jansen, T. L. C. (2023). Simulation of two-dimensional infrared Raman spectroscopy with application to proteins. Journal of Chemical Physics, 158(6), Article 064106. https://doi.org/10.1063/5.0138958
Erić, V., Castro, J. L., Li, X., Dsouza, L., Frehan, S. K., Huijser, A., Holzwarth, A. R., Buda, F., Sevink, G. J. A., de Groot, H. J. M., & Jansen, T. L. C. (2023). Ultrafast Anisotropy Decay Reveals Structure and Energy Transfer in Supramolecular Aggregates. Journal of Physical Chemistry B, 127(34), 7487-7496. https://doi.org/10.1021/acs.jpcb.3c04719
Manrho, M., Krishnaswamy, S. R., Kriete, B., Patmanidis, I., de Vries, A. H., Marrink, S. J., Jansen, T. L. C., Knoester, J., & Pshenichnikov, M. S. (2023). Watching Molecular Nanotubes Self-Assemble in Real Time. Journal of the American Chemical Society, 145(41), 22494–22503. https://doi.org/10.1021/jacs.3c07103

2022

Adrichem, K. E. V., & Jansen, T. L. C. (2022). AIM: A Mapping Program for Infrared Spectroscopy of Proteins. Journal of Chemical Theory and Computation, 18(5), 3089–3098. https://doi.org/10.1021/acs.jctc.2c00113
Saxena, V., Steendam, R., & Jansen, T. L. C. (2022). Distinguishing islet amyloid polypeptide fibril structures with infrared isotope-label spectroscopy. The Journal of Chemical Physics, 156(5), Article 055101. https://doi.org/10.1063/5.0082322
Manrho, M., Jansen, T. L. C., & Knoester, J. (2022). Optical signatures of the coupling between excitons and charge transfer states in linear molecular aggregates. Journal of Chemical Physics, 156(22), Article 224112. https://doi.org/10.1063/5.0095470
Bernhardt, R., Manrho, M., Zablocki, J., Rieland, L., Lützen, A., Schiek, M., Meerholz, K., Zhu, J., Jansen, T. L. C., Knoester, J., & Van Loosdrecht, P. H. M. (2022). Structural Disorder as the Origin of Optical Properties and Spectral Dynamics in Squaraine Nano-Aggregates. Journal of the American Chemical Society, 144(42), 19372–19381. https://doi.org/10.1021/jacs.2c07064
Gallop, N. P., Ye, J., Greetham, G. M., Jansen, T. L. C., Dai, L., Zelewski, S. J., Arul, R., Baumberg, J. J., Hoye, R. L. Z., & Bakulin, A. A. (2022). The effect of caesium alloying on the ultrafast structural dynamics of hybrid organic-inorganic halide perovskites. Journal of Materials Chemistry A, 10(42), 22408-22418. https://doi.org/10.1039/d2ta05207e
Nhut, T., Nguyen, H. L., Akhtar, P., Zhong, K., Jansen, T. L. C., Knoester, J., Caffarri, S., Lambrev, P. H., & Tan, H.-S. (2022). Ultrafast Excitation Energy Transfer Dynamics in the LHCII–CP29–CP24 Subdomain of Plant Photosystem II. The Journal of Physical Chemistry Letters, 13(19), 4263–4271. https://doi.org/10.1021/acs.jpclett.2c00194

2021

Nguyen, H. L., Do, T. N., Akhtar, P., Jansen, T. L. C., Knoester, J., Wang, W., Shen, J.-R., Lambrev, P. H., & Tan, H.-S. (2021). An Exciton Dynamics Model of Bryopsis corticulans Light-Harvesting Complex II. Journal of Physical Chemistry B, 125(4), 1134-1143. https://doi.org/10.1021/acs.jpcb.0c10634
Jansen, T. L. C. (2021). Computational spectroscopy of complex systems. Journal of Chemical Physics, 155(17), Article 170901. https://doi.org/10.1063/5.0064092
El Khoury, Y., Le Breton, G., Cunha, A. V., Jansen, T. L. C., van Wilderen, L. J. G. W., & Bredenbeck, J. (2021). Lessons from combined experimental and theoretical examination of the FTIR and 2D-IR spectroelectrochemistry of the amide I region of cytochrome c. Journal of Chemical Physics, 154(12), Article 124201. https://doi.org/10.1063/5.0039969
Kunsel, T., Günther, L. M., Köhler, J., Jansen, T. L. C., & Knoester, J. (2021). Probing size variations of molecular aggregates inside chlorosomes using single-object spectroscopy. Journal of Chemical Physics, 155(12), Article 124310. https://doi.org/10.1063/5.0061529
Majumdar, A., & Jansen, T. L. C. (2021). Quantum-Classical Simulation of Molecular Motors Driven Only by Light. JOURNAL OF PHYSICAL CHEMISTRY LETTERS, 12(23), 5512-5518. https://doi.org/10.1021/acs.jpclett.1c00951
Kunsel, T., Jansen, T. L. C., & Knoester, J. (2021). Scaling relations of exciton diffusion in linear aggregates with static and dynamic disorder. Journal of Chemical Physics, 155(13), Article 134305. https://doi.org/10.1063/5.0065206

2020

Bondarenko, A. S., Knoester, J., & Jansen, T. L. C. (2020). Comparison of methods to study excitation energy transfer in molecular multichromophoric systems. Chemical Physics, 529, Article 110478. https://doi.org/10.1016/j.chemphys.2019.110478
Raul, B. A. L., Luponosov, Y. N., Yang, W., Surin, N. M., Douheret, O., Min, J., Jansen, T. L. C., Ponomarenko, S. A., & Pshenichnikov, M. S. (2020). Excited state dynamics and exciton diffusion in triphenylamine/dicyanovinyl push-pull small molecule for organic optoelectronics. Scientific Reports, 10(1), Article 21198. https://doi.org/10.1038/s41598-020-78197-2
Bondarenko, A. S., Jansen, T. L. C., & Knoester, J. (2020). Exciton localization in tubular molecular aggregates: Size effects and optical response. Journal of Chemical Physics, 152(19), Article 194302. https://doi.org/10.1063/5.0008688
Kriete, B., Bondarenko, A. S., Alessandri, R., Patmanidis, I., Krasnikov, V. V., Jansen, T. L. C., Marrink, S. J., Knoester, J., & Pshenichnikov, M. S. (2020). Molecular versus excitonic disorder in individual artificial light-harvesting systems. Journal of the American Chemical Society, 142(42), 18073-18085. Article jacs.0c07392. https://doi.org/10.1021/jacs.0c07392
Bondarenko, A. S., Patmanidis, I., Alessandri, R., Souza, P. C. T., Jansen, T. L. C., de Vries, A. H., Marrink, S. J., & Knoester, J. (2020). Multiscale modeling of molecular structure and optical properties of complex supramolecular aggregates. Chemical Science, 11(42), 11514-11524. https://doi.org/10.1039/d0sc03110k
Sardjan, A. S., Westerman, F. P., Ogilvie, J. P., & Jansen, T. L. C. (2020). Observation of Ultrafast Coherence Transfer and Degenerate States with Polarization-Controlled Two-Dimensional Electronic Spectroscopy. Journal of Physical Chemistry B, 124(42), 9420-9427. https://doi.org/10.1021/acs.jpcb.0c08126
Cao, J., Cogdell, R. J., Coker, D. F., Duan, H.-G., Hauer, J., Kleinekathoefer, U., Jansen, T. L. C., Mancal, T., Miller, R. J. D., Ogilvie, J. P., Prokhorenko, V., Renger, T., Tan, H.-S., Tempelaar, R., Thorwart, M., Thyrhaug, E., Westenhoff, S., & Zigmantas, D. (2020). Quantum biology revisited. Science Advances, 6(14), Article eaaz4888. https://doi.org/10.1126/sciadv.aaz4888
Kunsel, T., Loehner, A., Mayo, J. J., Koehler, J., Jansen, T. L. C., & Knoester, J. (2020). Unraveling intra-aggregate structural disorder using single-molecule spectroscopy. Journal of Chemical Physics, 153(13), Article 134304. https://doi.org/10.1063/5.0023551
Baiz, C. R., Blasiak, B., Bredenbeck, J., Cho, M., Choi, J.-H., Corcelli, S. A., Dijkstra, A. G., Feng, C.-J., Garrett-Roe, S., Ge, N.-H., Hanson-Heine, M. W. D., Hirst, J. D., Jansen, T. L. C., Kwac, K., Kubarych, K. J., Londergan, C. H., Maekawa, H., Reppert, M., Saito, S., ... Zanni, M. T. (2020). Vibrational Spectroscopic Map, Vibrational Spectroscopy, and Intermolecular Interaction. Chemical reviews, 120(15), 7152-7218. https://doi.org/10.1021/acs.chemrev.9b00813

2019

Kriete, B., Luettig, J., Kunsel, T., Maly, P., Jansen, T. L. C., Knoester, J., Brixner, T., & Pshenichnikov, M. S. (2019). Interplay between structural hierarchy and exciton diffusion in artificial light harvesting. Nature Communications, 10, Article 4615. https://doi.org/10.1038/s41467-019-12345-9
Kunsel, T., Tiwari, V., Matutes, Y. A., Gardiner, A. T., Cogdell, R. J., Ogilvie, J. P., & Jansen, T. L. C. (2019). Simulating Fluorescence-Detected Two-Dimensional Electronic Spectroscopy of Multichromophoric Systems. Journal of Physical Chemistry B, 123(2), 394-406. https://doi.org/10.1021/acs.jpcb.8b10176
Loehner, A., Kunsel, T., Roehr, M. I. S., Jansen, T. L. C., Sengupta, S., Wuerthner, F., Knoester, J., & Koehler, J. (2019). Spectral and Structural Variations of Biomimetic Light-Harvesting Nanotubes. JOURNAL OF PHYSICAL CHEMISTRY LETTERS, 10(11), 2715-2724. https://doi.org/10.1021/acs.jpclett.9b00303
Jansen, T. L. C., Saito, S., Jeon, J., & Cho, M. (2019). Theory of coherent two-dimensional vibrational spectroscopy. Journal of Chemical Physics, 150(10), Article 100901. https://doi.org/10.1063/1.5083966
Zhang, Q., Solanki, A., Parida, K., Giovanni, D., Li, M., Jansen, T. L. C., Pshenichnikov, M. S., & Sum, T. C. (2019). Tunable Ferroelectricity in Ruddlesden-Popper Halide Perovskites. ACS Applied Materials & Interfaces, 11(14), 13523-13532. https://doi.org/10.1021/acsami.8b21579
Jansen, T. L. C. (2019). Unraveling Molecular Packing in Two-Dimensional Excitonic Systems. Chem, 5(12), 3010-3012. https://doi.org/10.1016/j.chempr.2019.11.011

2018

Kopec, W., Koepfer, D. A., Vickery, O. N., Bondarenko, A. S., Jansen, T. L. C., de Groot, B. L., & Zachariae, U. (2018). Direct knock-on of desolvated ions governs strict ion selectivity in K+ channels. Nature Chemistry, 10(8), 813-820. https://doi.org/10.1038/s41557-018-0105-9
Salamatova, E., Cunha, A. V., Bloem, R., Roeters, S. J., Woutersen, S., Jansen, T. L. C., & Pshenichnikov, M. S. (2018). Hydrophobic Collapse in N-Methylacetamide Water Mixtures. The Journal of Physical Chemistry. A: Molecules, Spectroscopy, Kinetics, Environment, & General Theory, 122(9), 2468-2478. https://doi.org/10.1021/acs.jpca.8b00276
Thyrhaug, E., Tempelaar, R., Alcocer, M. J. P., Zidek, K., Bina, D., Knoester, J., Jansen, T. L. C., & Zigmantas, D. (2018). Identification and characterization of diverse coherences in the Fenna-Matthews-Olson complex. Nature Chemistry, 10(7), 780-786. https://doi.org/10.1038/s41557-018-0060-5
Gallop, N. P., Selig, O., Giubertoni, G., Bakker, H. J., Rezus, Y. L. A., Frost, J. M., Jansen, T. L. C., Lovrincic, R., & Bakulin, A. A. (2018). Rotational Cation Dynamics in Metal Halide Perovskites: Effect on Phonons and Material Properties. JOURNAL OF PHYSICAL CHEMISTRY LETTERS, 9(20), 5987-5997. https://doi.org/10.1021/acs.jpclett.8b02227
Jansen, T. L. C. (2018). Simple Quantum Dynamics with Thermalization. The Journal of Physical Chemistry. A: Molecules, Spectroscopy, Kinetics, Environment, & General Theory, 122(1), 172-183. https://doi.org/10.1021/acs.jpca.7b10380
Bari, S., Egorov, D., Jansen, T. L. C., Boll, R., Hoekstra, R., Techert, S., Zamudio-bayer, V., Bülow, C., Lindblad, R., Leistner, G., Ławicki, A., Hirsch, K., Miedema, P. S., Von Issendorf, B., Lau, T., & Schlathölter, T. (2018). Soft X-ray spectroscopy as a probe for gas-phase protein structure: Electron impact ionization from within. Chemistry, 24(30), 7631-7636. https://doi.org/10.1002/chem.201801440
Tiwari, V., Matutes, Y. A., Gardiner, A. T., Jansen, T. L. C., Cogdell, R. J., & Ogilvie, J. P. (2018). Spatially-resolved fluorescence-detected two-dimensional electronic spectroscopy probes varying excitonic structure in photosynthetic bacteria. Nature Communications, 9, Article 4219. https://doi.org/10.1038/s41467-018-06619-x
Guenther, L. M., Loehner, A., Reiher, C., Kunsel, T., Jansen, T. L. C., Tank, M., Bryant, D. A., Knoester, J., & Koehler, J. (2018). Structural Variations in Chlorosomes from Wild-Type and a bchQR Mutant of Chlorobaculum tepidum Revealed by Single-Molecule Spectroscopy. Journal of Physical Chemistry B, 122(26), 6712-6723. https://doi.org/10.1021/acs.jpcb.8b02875
Selig, O., Cunha, A. V., van Eldijk, M. B., van Hest, J. C. M., Jansen, T. L. C., Bakker, H. J., & Rezus, Y. L. A. (2018). Temperature-Induced Collapse of Elastin-like Peptides Studied by 2DIR Spectroscopy. Journal of Physical Chemistry B, 122(34), 8243-8254. https://doi.org/10.1021/acs.jpcb.8b05221
Farag, M. H., Jansen, T. L. C., & Knoester, J. (2018). The origin of absorptive features in the two-dimensional electronic spectra of rhodopsin. PPCP : Physical Chemistry Chemical Physics, 20(18), 12746-12754. https://doi.org/10.1039/c8cp00638e

2017

Tran, H., Cunha, A. V., Shephard, J. J., Shalit, A., Hamm, P., Jansen, T. L. C., & Salzmann, C. G. (2017). 2D IR spectroscopy of high-pressure phases of ice. Journal of Chemical Physics, 147(14), Article 144501 - 144511. https://doi.org/10.1063/1.4993952
Tempelaar, R., Jansen, T. L. C., & Knoester, J. (2017). Exciton-Exciton Annihilation Is Coherently Suppressed in H-Aggregates, but Not in J-Aggregates. The Journal of Physical Chemistry Letters, 8(24), 6113-6117. https://doi.org/10.1021/acs.jpclett.7b02745, https://doi.org/10.48550/arxiv.1705.05861
Salamatova, E., Cunha, A. V., Shinokita, K., Jansen, T. L. C., & Pshenichnikov, M. S. (2017). Hydrogen bond and lifetime dynamics in diluted alcohols. PPCP : Physical Chemistry Chemical Physics, 19(41), 27960-27967. https://doi.org/10.1039/c7cp03222f
Cunha, A. V., Salamatova, E., Bloem, R., Roeters, S. J., Woutersen, S., Pshenichnikov, M. S., & Jansen, T. L. C. (2017). Interplay between Hydrogen Bonding and Vibrational Coupling in Liquid N-Methylacetamide. The Journal of Physical Chemistry Letters, 8(11), 2438-2444. https://doi.org/10.1021/acs.jpclett.7b00731
Selig, O., Sadhanala, A., Muller, C., Lovrincic, R., Chen, Z., Rezus, Y. L. A., Frost, J. M., Jansen, T. L. C., & Bakulin, A. A. (2017). Organic Cation Rotation and Immobilization in Pure and Mixed Methylammonium Lead-Halide Perovskites. Journal of the American Chemical Society, 139(11), 4068-4074. https://doi.org/10.1021/jacs.6b12239
Farag, M. H., Hoenders, B. J., Knoester, J., & Jansen, T. L. C. (2017). Spectral line shapes in linear absorption and two-dimensional spectroscopy with skewed frequency distributions. Journal of Chemical Physics, 146(23), Article 234201. https://doi.org/10.1063/1.4985665
Kriete, B., Bondarenko, A. S., Jumde, V. R., Franken, L. E., Minnaard, A. J., Jansen, T. L. C., Knoester, J., & Pshenichnikov, M. S. (2017). Steering Self-Assembly of Amphiphilic Molecular Nanostructures via Halogen Exchange. The Journal of Physical Chemistry Letters, 8(13), 2895-2901. https://doi.org/10.1021/acs.jpclett.7b00967
Frederix, P. W. J. M., Idé, J., Altay, Y., Schaeffer, G., Surin, M., Beljonne, D., Bondarenko, A. S., Jansen, T. L. C., Otto, S., & Marrink, S. J. (2017). Structural and Spectroscopic Properties of Assemblies of Self-Replicating Peptide Macrocycles. Acs Nano, 11(8), 7858-7868. https://doi.org/10.1021/acsnano.7b02211
Johnson, P. J. M., Farag, M. H., Halpin, A., Morizumi, T., Prokhorenko, V. I., Knoester, J., Jansen, T. L. C., Ernst, O. P., & Miller, R. J. D. (2017). The Primary Photochemistry of Vision Occurs at the Molecular Speed Limit. The Journal of Physical Chemistry. B: Materials, Surfaces, Interfaces, & Biophysical, 121(16), 4040-4047. https://doi.org/10.1021/acs.jpcb.7b02329

2016

Cunha, A. V., Bondarenko, A. S., & Jansen, T. L. C. (2016). Assessing Spectral Simulation Protocols for the Amide I Band of Proteins. Journal of Chemical Theory and Computation, 12(8), 3982-3992. https://doi.org/10.1021/acs.jctc.6b00420
Tempelaar, R., Koster, J. A., Havenith, R., Knoester, J., & Jansen, T. (2016). Charge recombination suppressed by destructive quantum interference in heterojunction materials. Abstracts of Papers of the American Chemical Society, 252.
Tempelaar, R., Koster, L. J. A., Havenith, R. W. A., Knoester, J., & Jansen, T. L. C. (2016). Charge Recombination Suppressed by Destructive Quantum Interference in Heterojunction Materials. The Journal of Physical Chemistry Letters, 7(1), 198-203. https://doi.org/10.1021/acs.jpclett.5b02580
Tempelaar, R., Koster, L. J. A., Havenith, R. W. A., Knoester, J., & Jansen, T. L. C. (2016). Correction to “Charge Recombination Suppressed by Destructive Quantum Interference in Heterojunction Materials”. The Journal of Physical Chemistry Letters, 7(18), 3659-3659. https://doi.org/10.1021/acs.jpclett.6b01956
Tempelaar, R., Halpin, A., Johnson, P. J. M., Cai, J., Murphy, R. S., Knoester, J., Miller, R. J. D., & Jansen, T. L. C. (2016). Laser-Limited Signatures of Quantum Coherence. The Journal of Physical Chemistry. A: Molecules, Spectroscopy, Kinetics, Environment, & General Theory, 120(19), 3042-3048. https://doi.org/10.1021/acs.jpca.5b10312
Farag, M. H., Jansen, T. L. C., & Knoester, J. (2016). Probing the Interstate Coupling near a Conical Intersection by Optical Spectroscopy. The Journal of Physical Chemistry Letters, 7(17), 3328-3334. https://doi.org/10.1021/acs.jpclett.6b01463
Shi, L., Skinner, J. L., & Jansen, T. L. C. (2016). Two-dimensional infrared spectroscopy of neat ice I-h. PPCP : Physical Chemistry Chemical Physics, 18(5), 3772-3779. https://doi.org/10.1039/c5cp07264f

2015

Bondarenko, A. S., & Jansen, T. L. C. (2015). Application of two-dimensional infrared spectroscopy to benchmark models for the amide I band of proteins. Journal of Chemical Physics, 142(21), Article 212437. https://doi.org/10.1063/1.4919716
van der Vegte, N., Prajapati, J., Kleinekathoefer, U., Knoester, J., & Jansen, T. (2015). Atomistic Modeling of Two-Dimensional Electronic Spectra and Excited State Dynamics for a Light Harvesting 2 Complex. The Journal of Physical Chemistry B, 119(4), 1302–1313. https://doi.org/10.1021/jp509247p
Hestand, N. J., Tempelaar, R., Knoester, J., Jansen, T. L. C., & Spano, F. C. (2015). Exciton mobility control through sub − Å packing modifications in molecular crystals. Physical Review. B: Condensed Matter and Materials Physics, 91(19), Article 195315. https://doi.org/10.1103/PhysRevB.91.195315
Shinokita, K., Cunha, A. V., Jansen, T. L. C., & Pshenichnikov, M. S. (2015). Hydrogen bond dynamics in alcohols studied by 2D IR spectroscopy. In Ultrafast Phenomena XIX - Proceedings of the 19th International Conference (Vol. 162, pp. 466-470). (Springer Proceedings in Physics; Vol. 462). Springer Science and Business Media, LLC. https://doi.org/10.1007/978-3-319-13242-6_114
Shinokita, K., Cunha, A. V., Jansen, T. L. C., & Pshenichnikov, M. S. (2015). Hydrogen bond dynamics in bulk alcohols. Journal of Chemical Physics, 142(21), Article 212450. https://doi.org/10.1063/1.4921574
Bakulin, A. A., Selig, O., Bakker, H. J., Rezus, Y. L. A., Mueller, C., Glaser, T., Lovrincic, R., Sun, Z., Chen, Z., Walsh, A., Frost, J. M., & Jansen, T. L. C. (2015). Real-Time Observation of Organic Cation Reorientation in Methylammonium Lead Iodide Perovskites. The Journal of Physical Chemistry Letters, 6(18), 3663-3669. https://doi.org/10.1021/acs.jpclett.5b01555
Kruiger, J. F., van der Vegte, C. P., & Jansen, T. (2015). Suppressing sampling noise in linear and two-dimensional spectral simulations. Journal of Chemical Physics, 142(5), Article 054201. https://doi.org/10.1063/1.4907277

2014

Jansen, T. L. C. (2014). Linear Absorption and Two-Dimensional Infrared Spectra of N-Methylacetamide in Chloroform Revisited: Polarizability and Multipole Effects. The Journal of Physical Chemistry B, 118(28), 8162-8169. https://doi.org/10.1021/jp5012445
Tempelaar, R., Spano, F. C., Knoester, J., & Jansen, T. L. C. (2014). Mapping the Evolution of Spatial Exciton Coherence through Time-Resolved Fluorescence. The Journal of Physical Chemistry Letters, 5(9), 1505-1510. https://doi.org/10.1021/jz500488u
van der Vegte, C. P., Knop, S., Voehringer, P., Knoester, J., & Jansen, T. L. C. (2014). OH-Stretching in Synthetic Hydrogen-Bonded Chains. The Journal of Physical Chemistry B, 118(23), 6256-6264. https://doi.org/10.1021/jp504267h
Halpin, A., Johnson, P. J. M., Tempelaar, R., Murphy, R. S., Knoester, J., Jansen, T. L. C., & Miller, R. J. D. (2014). Two-dimensional spectroscopy of a molecular dimer unveils the effects of vibronic coupling on exciton coherences. Nature Chemistry, 6(3), 196-201. https://doi.org/10.1038/NCHEM.1834
Tempelaar, R., Jansen, T. L. C., & Knoester, J. (2014). Vibrational Beatings Conceal Evidence of Electronic Coherence in the FMO Light-Harvesting Complex. The Journal of Physical Chemistry B, 118(45), 12865-12872. https://doi.org/10.1021/jp510074q

2013

van der Vegte, C. P., Dijkstra, A. G., Knoester, J., & Jansen, T. L. C. (2013). Calculating Two-Dimensional Spectra with the Mixed Quantum-Classical Ehrenfest Method. The Journal of Physical Chemistry A, 117(29), 5970-5980. https://doi.org/10.1021/jp311668r
Bakulin, A. A., Cringus, D., Pieniazek, P. A., Skinner, J. L., Jansen, T. L. C., & Pshenichnikov, M. S. (2013). Dynamics of Water Confined in Reversed Micelles: Multidimensional Vibrational Spectroscopy Study. Journal of Physical Chemistry B, 117(49), 15545-15558. https://doi.org/10.1021/jp405853j
Liang, C., & Jansen, T. L. C. (2013). Simulation of Two-Dimensional Sum-Frequency Generation Response Functions: Application to Amide I in Proteins. Journal of Physical Chemistry B, 117(23), 6937-6945. https://doi.org/10.1021/jp403111j
Tempelaar, R., van der Vegte, C. P., Knoester, J., & Jansen, T. L. C. (2013). Surface hopping modeling of two-dimensional spectra. Journal of Chemical Physics, 138(16), 164106-1-164106-10. Article 164106. https://doi.org/10.1063/1.4801519
Liang, C., Louhivuori, M., Marrink, S. J., Jansen, T. L. C., & Knoester, J. (2013). Vibrational Spectra of a Mechanosensitive Channel. JOURNAL OF PHYSICAL CHEMISTRY LETTERS, 4(3), 448-452. https://doi.org/10.1021/jz3019258

2012

Liang, C., & Jansen, T. L. C. (2012). An Efficient N-3-Scaling Propagation Scheme for Simulating Two-Dimensional Infrared and Visible Spectra. Journal of Chemical Theory and Computation, 8(5), 1706-1713. https://doi.org/10.1021/ct300045c
Jansen, T. L. C., Dijkstra, A. G., Watson, T. M., Hirst, J. D., & Knoester, J. (2012). Erratum: “Modeling the amide I bands of small peptides” [J. Chem. Phys. 125, 044312 (2006)]. Journal of Chemical Physics, 136(20), Article 209901. https://doi.org/10.1063/1.4722584
Lessing, J., Roy, S., Reppert, M., Baer, M., Marx, D., Jansen, T. L. C., Knoester, J., & Tokmakoff, A. (2012). Identifying Residual Structure in Intrinsically Disordered Systems: A 2D IR Spectroscopic Study of the GVGXPGVG Peptide. Journal of the American Chemical Society, 134(11), 5032-5035. https://doi.org/10.1021/ja2114135
Liang, C., Knoester, J., & Jansen, T. L. C. (2012). Proton Transport in a Membrane Protein Channel: Two-Dimensional Infrared Spectrum Modeling. Journal of Physical Chemistry B, 116(22), 6336-6345. https://doi.org/10.1021/jp3019827

2011

Roy, S., Pshenichnikov, M. S., & Jansen, T. L. C. (2011). Analysis of 2D CS Spectra for Systems with Non-Gaussian Dynamics. Journal of Physical Chemistry B, 115(18), 5431-5440. https://doi.org/10.1021/jp109742p
Olbrich, C., Jansen, T. L. C., Liebers, J., Aghtar, M., Struempfer, J., Schulten, K., Knoester, J., Kleinekathoefer, U., & Strümpfer, J. (2011). From Atomistic Modeling to Excitation Transfer and Two-Dimensional Spectra of the FMO Light-Harvesting Complex. Journal of Physical Chemistry B, 115(26), 8609-8621. https://doi.org/10.1021/jp202619a
Dijkstra, A. G., Jansen, T. L. C., & Knoester, J. (2011). Modeling the Vibrational Dynamics and Nonlinear Infrared Spectra of Coupled Amide I and II Modes in Peptides. Journal of Physical Chemistry B, 115(18), 5392-5401. https://doi.org/10.1021/jp109431a
Knop, S., Jansen, T. L. C., Lindner, J., & Voehringer, P. (2011). On the nature of OH-stretching vibrations in hydrogen-bonded chains: Pump frequency dependent vibrational lifetime. Physical Chemistry Chemical Physics, 13(10), 4641-4650. https://doi.org/10.1039/c0cp02143a
Liang, C., & Jansen, T. L. C. (2011). Proton transport in a binary biomimetic solution revealed by molecular dynamics simulation. Journal of Chemical Physics, 135(11), Article 114502. https://doi.org/10.1063/1.3636381
Liang, C., Jansen, T. L. C., & Knoester, J. (2011). Proton transport in biological systems can be probed by two-dimensional infrared spectroscopy. Journal of Chemical Physics, 134(4), 044502-1-044502-8. Article 044502. https://doi.org/10.1063/1.3522770
Roy, S., Lessing, J., Meisl, G., Ganim, Z., Tokmakoff, A., Knoester, J., & Jansen, T. L. C. (2011). Solvent and conformation dependence of amide I vibrations in peptides and proteins containing proline. Journal of Chemical Physics, 135(23), 234507-1-234507-11. Article 234507. https://doi.org/10.1063/1.3665417

2010

Smith, A. W., Lessing, J., Ganim, Z., Peng, C. S., Tokmakoff, A., Roy, S., Jansen, T. L. C., & Knoester, J. (2010). Melting of a beta-Hairpin Peptide Using Isotope-Edited 2D IR Spectroscopy and Simulations. Journal of Physical Chemistry B, 114(34), 10913-10924. https://doi.org/10.1021/jp104017h
Roy, S., Jansen, T. L. C., & Knoester, J. (2010). Structural classification of the amide I sites of a beta-hairpin with isotope label 2DIR spectroscopy. Physical Chemistry Chemical Physics, 12(32), 9347-9357. https://doi.org/10.1039/b925645h
Jansen, T. L. C., Auer, B. M., Yang, M., & Skinner, J. L. (2010). Two-dimensional infrared spectroscopy and ultrafast anisotropy decay of water. Journal of Chemical Physics, 132(22), Article 224503. https://doi.org/10.1063/1.3454733
Dijkstra, A. G., Jansen, T. L. C., & Knoester, J. (2010). Two-Dimensional Spectroscopy of Extended Molecular Systems: Applications to Energy Transport and Relaxation in an alpha-Helix. The Journal of Physical Chemistry A, 114(27), 7315-7320. https://doi.org/10.1021/jp9111124

2009

Jansen, T. L. C., Cringus, D., & Pshenichnikov, M. S. (2009). Dissimilar Dynamics of Coupled Water Vibrations. The Journal of Physical Chemistry A, 113(22), 6260-6265. https://doi.org/10.1021/jp900480r
Cringus, D., Jansen, T. I. C., Pshenichnikov, M. S., & Schoenlein, RW. (2009). Heterogeneous Dynamics of Coupled Vibrations. In P. Corkum, S. DeSilvestri, KA. Nelson, E. Riedle, & R. W. Schoenlein (Eds.), Ultrafast Phenomena XVI: Proceedings of the 16th International Conference (Vol. 92, pp. 472-474). (Springer Series in Chemical Physics; Vol. 92). Springer.
Bakulin, A. A., Liang, C., Jansen, T. L. C., Wiersma, D. A., Bakker, H. J., & Pshenichnikov, M. S. (2009). Hydrophobic Solvation: A 2D IR Spectroscopic Inquest. Accounts of Chemical Research, 42(9), 1229-1238. https://doi.org/10.1021/ar9000247
Jansen, T. L. C., & Knoester, J. (2009). Waiting Time Dynamics in Two-Dimensional Infrared Spectroscopy. Accounts of Chemical Research, 42(9), 1405-1411. https://doi.org/10.1021/ar900025a
Last modified:09 June 2023 8.36 p.m.