Search: groenenboom
- Para-ortho H2 conversion in collisions with NO; a surprising mechanism
Ad van der Avoird and Gerrit C. Groenenboom
J. Chem. Phys., 165, 054110 (2026)
[doi]
[pdf]
[Interview]
[Supplement]
©
- Collisional rate coefficients for OH-H2 at high temperatures
Z. van den Heuvel, B. Tabone, E. F. van Dishoeck, G. C. Groenenboom, and A. van der Avoird
Astron. Astrophys., 711, A61 (2026)
[doi]
[arXiv:2512.08420]
[pdf]
- Rovibrational cross sections for the CO2 0000, 0110, 0220 and Fermi resonance states 1000(1) and 1000(2) in collisions with He atoms
Jelena Bošković Taha, Floris F. S. van der Tak, and Gerrit C. Groenenboom
in preparation, y, x (2026)
- Production and Detection of mj-resolved Samples of ND3
Pierre Sustar, Christopher Sparling, Irene de Vries, Robin Verwegen, Gerrit C. Groenenboom, and Sebastiaan van de Meerakker
Mol. Phys., 0, e2610003 (2026)
[doi]
[pdf]
- High-resolution ro-vibrational and rotational spectroscopy of the open-shell, linear CCH+ (3Π) ion
Kim Steenbakkers, Weslley G. D. P. Silva, Oskar Asvany, Gerrit C. Groenenboom, Pavol Jusko, Britta Redlich, Sandra Brünken, and Stephan Schlemmer
J. Phys. Chem. A, 130, 3163 (2026)
[doi]
[arXiv:2605.00564]
[pdf]
[part II]
[Supplement]
- Experimental proof of strong Π-Σ mixing in the Renner-Teller and Psudo-Jahn-Teller affected CCH+ (3Π) ion
Kim Steenbakkers, Bryan P. Changala, Weslley G. D. P. Silva, John F. Stanton, Filippo Lipparini, Jürgen Gauss, Oskar Asvany, Gerrit C. Groenenboom, Britta Redlich, Stephan Schlemmer, and Sandra Brünken
J. Phys. Chem. Lett., 17, 4732 (2026)
[doi]
[arXiv:2604.09203]
[pdf]
[Supplement]
- First detection of C2H+ in the interstellar medium
Arshia M. Jacob, Karl M. Menten, Sandra Bruenken, Arnaud Belloche, Friedrich Wyrowski, Weslley G. D. P. Silva, Oskar Asvany, Sarwar Khan, Slawa Kabonovic, Kim Steenbakkers, Gerrit C. Groenenboom, Britta Redlich, and Stephan Schlemmer
Astron. Astrophys., accepted, x (2026)
[arXiv:2608.08014]
- CO2-He rovibrational transition rates: A complete state-to-state collisional dataset
Jelena Bošković, A. M. Abrabhavi, A. Bosman, Gerrit C. Groenenboom, and Floris F. S. van der Tak
in preparation, y, x (2026)
- Gas-phase, conformer-specific infrared spectra of 3-chlorophenol and 3-fluorophenol
Olga A. Duda, Alexander K. Lemmens, Gerrit C. Groenenboom, Daniel A. Horke, and Joost M. Bakker
Phys. Chem. Chem. Phys., 27, 7565 (2025)
[doi]
[pdf]
[part II]
[Supplement]
- Leak-out spectroscopy as alternative method to rare-gas tagging for Renner-Teller perturbed HCCH+ and DCCD+ ions
Kim Steenbakkers, Tom van Boxtel, Gerrit C. Groenenboom, Oskar Asvany, Britta Redlich, Stephan Schlemmer, and Sandra Brünken
Phys. Chem. Chem. Phys., 26, 2692 (2024)
[doi]
[pdf]
[Supplement]
- BASECOL2023 scientific content
M. L. Dubernet, C. Boursier, O. Denis-Alpizar, Y. A. Ba, N. Moreau, C. M. Zwölf, M. A. Amor, D. Babikov, N. Balakrishnan, C. Balança, M. Ben Khalifa, A. Bergeat, C. T. Bop, L. Cabrera-Conzález, C. Cárdenas, A. Chefai, P. J. Dagdigian, F. Dayou, S. Demes, B. Desrousseaux, F. Dumouchel, A. Faure, R. C. Forrey, J. Franz, R. M. García-Vázquez, F. Gianturco, A. Godard Palluet, L. González-Sánchez, G. C. Groenenboom, P. Halvick, K. Hammani, F. Khadri, Y. Kalugina, I. Kleiner, J. KŁos, F. Lique, J. Loreau, B. Mandal, B. Mant, S. Marinakis, D. Ndaw, P. Pirlot Jankowiak, T. Price, E. Quantas-Sanchez, R. Ramachandran, E. Sahnoun, C. Satander, P. C. Stancil, T. Stoecklin, J. Tennyson, F. Tonolo, R. Urzúa-Leiva, B. Yang, E. Yurtsever, and Michal Żóltowski
Astron. & Astrophys., 683, A40 (2024)
[doi]
[pdf]
- Quantum state-resolved molecular dipolar collisions over four decades of energy
Guoqiang Tang, Matthieu Besemer, Stach Kuijpers, Gerrit C. Groenenboom, Ad van der Avoird, Tijs Karman, and Sebastiaan Y. T. van de Meerakker
Science, 379, 1031 (2023)
[doi]
[arXiv:2302.06866]
[pdf]
[Supplement]
- A vibrational action spectroscopic study of the Renner-Teller- and spin-orbit-affected cyanoacetylene radical cation HC3N+
Kim Steenbakkers, Aravindh N. Marimuthu, Britta Redlich, Gerrit C. Groenenboom, and Sandra Brünken
J. Chem. Phys., 158, 084305 (2023)
[doi]
[data]
[pdf]
©
- Quantum simulator to emulate lower-dimensional molecular structure
E. Sierda, X. Huang, D. I. Badrtdinov, B. Kiraly, E. J. Knol, G. C. Groenenboom, M. I. Katsnelson, M Rösner, D. Wegner, and A. A. Khajetoorians
Science, 380, 1048 (2023)
[doi]
[https://repository.ubn.ru.nl/handle/2066/293653]
[pdf]
[Supplement]
- State-to-state rovibrational transition rates for CO2 in the bend mode in collisions with He atoms
Taha Selim, Ad van der Avoird, and Gerrit C. Groenenboom
J. Chem. Phys., 159, 164310 (2023)
[doi]
[arXiv:2309.03781]
[pdf]
[part II]
[Supplement]
©
- Tomography of Feshbach resonance states
Baruch Margulis, Karl P. Horn, Daniel M. Reid, Meenu Upadhyay, Nitzan Kahn, Arthur Christianen, Ad van der Avoird, Gerrit C. Groenenboom, Markus Meuwly, Christiane P. Koch, and Edvardas Narevicius
Science, 380, 77 (2023)
[doi]
[arXiv:2212.02828]
[pdf]
[Supplement]
- Lecture: Quantum Theoretical Chemistry
Gerrit C. Groenenboom (Nijmegen, 2023)
[pdf]
- Correlated rotational excitations in NO-CO inelastic collisions
Guoqiang Tang, Matthieu Besemer, Jolijn Onvlee, Tijs Karman, Ad van der Avoird, Gerrit C. Groenenboom, and Sebastiaan Y. T. van de Meerakker
J. Chem. Phys., 156, 214304 (2022)
[doi]
[pdf]
©
- Efficient computational methods for rovibrational transition rates in molecular collisions
Taha Selim, Ad van der Avoird, and Gerrit C. Groenenboom
J. Chem. Phys., 157, 064105 (2022)
[doi]
[arXiv:2206.04470]
[pdf]
©
- Ab initio study of the reactivity of ultracold RbSr + RbSr collisions
Marijn P. Man, Tijs Karman, and Gerrit C. Groenenboom
New J. Phys., 24, 055001 (2022)
[doi]
[arXiv:2108.02511]
[pdf]
- Symmetry breaking in sticky collisions between ultracold molecules
Marijn P. Man, Gerrit C. Groenenboom, and Tijs Karman
Phys. Rev. Lett., 129, 243401 (2022)
[doi]
[arXiv:2203.13598]
[pdf]
[Supplement]
- Mapping partial wave dynamics of low-energy NO-He rotational de-excitation collisions
Tim de Jongh, Quan Shuai, Grite L. Abma, Stach Kuijpers, Matthieu Besemer, Ad van der Avoird, Gerrit C. Groenenboom, and Sebastiaan Y. T. van de Meerakker
Nature Chem., 14, 538 (2022)
[doi]
[pdf]
[Supplement]
- Many-electron dynamics in high-order harmonic generation of niobium: a time-dependent density-functional-theory study
Xi Chu and Gerrit C. Groenenboom
Phys. Rev. A, 105, 053110 (2022)
[doi]
[pdf]
- Glory scattering in deeply inelastic molecular collisions
Matthieu Besemer, Guoqiang Tang, Zhi Gao, Ad van der Avoird, Gerrit C. Groenenboom, Sebastiaan Y. T. van de Meerakker, and Tijs Karman
Nature Chem., 14, 664 (2022)
[doi]
[pdf]
[Supplement]
- Memorial viewpoint for Joop van Lenthe
Gabriel Balint-Kurti, Ria Broer, Peter H. M. Budzelaar, Huub J. J. van Dam, Fokke Dijkstra, Henk Eshuis, Gerrit C. Groenenboom, Martyn F. Guest, Remco W. A. Havenith, Anthony J. H. M. Meijer, Tanja van Mourik, and Rashid Zahid
J. Phys. Chem. A, 126, 7415 (2022)
[doi]
[pdf]
- Para-ortho hydrogen conversion: solving a 90-year old mystery
Xia Zhang, Tijs Karman, Gerrit C. Groenenboom, and Ad van der Avoird
Nat. Sci., 1, e10002 (2021)
[doi]
[https://onlinelibrary.wiley.com/doi/epdf/10.1002/ntls.10002]
[pdf]
[Supplement]
- Laser ionisation detection of O(3Pj) atoms in the VUV; application to photodissociation of O2
Xu-Dong Wang, David H. Parker, Sebastiaan Y. T. van de Meerakker, Gerrit C. Groenenboom, and Jolijn Onvlee
Mol. Phys., online, e1979264 (2021)
[doi]
[arXiv:2107.12697]
[pdf]
- Quantifying the interplay between fine structure and geometry of an individual molecule on a surface
Manuel Steinbrecher, Werner M. J. van Weerdenburg, Etienne F. Walraven, Niels P. E. van Mullekom, Jan W. Gerritsen, Fabian D. Natterer, Danis I. Badrtdinov, Alexander N. Rudenko, Vladimir V. Mazurenko, Mikhail I. Katsnelson, Ad van der Avoird, Gerrit C. Groenenboom, and Alexander A. Khajetoorians
Phys. Rev. B, 103, 155405 (2021)
[doi]
[arXiv:2007.01928]
[pdf]
[Supplement]
- Multi-channel Distorted-Wave Born approximation for rovibrational transition rates in molecular collisions
Taha Selim, Arthur Christianen, Ad van der Avoird, and Gerrit C. Groenenboom
J. Chem. Phys., 155, 034105 (2021)
[doi]
[pdf]
[Supplement]
©
- Magnetic anisotropy of individually addressed spin states
L. C. J. M. Peters, P. C. M. Christianen, H. Engelkamp, G. C. Groenenboom, J. C. Maan, E. Kampert, P. T. Tinnemans, A. E. Rowan, and U. Zeitler
Phys. Rev. Res., 3, L042042 (2021)
[doi]
[arXiv:2110.13685]
[pdf]
- Molecular Dynamics Simulations of Energy Dissipation on Amorphous Solid Water: Testing the Validity of Equipartition
A. Fredon, G. C. Groenenboom, and H. M. Cuppen
ACS Earth Space Chem., 5, 2032 (2021)
[doi]
[pdf]
[Supplement]
- Lossy quantum defect theory of ultracold molecular collisions
Arthur Christianen, Gerrit C. Groenenboom, and Tijs Karman
Phys. Rev. A, 104, 043327 (2021)
[doi]
[arXiv:2108.02724]
[pdf]
- Collision induced spin-orbit relaxation of highly vibrationally excited NO near 1 K
Chandika Amarasinghe, Chatura A. Perera, Junxiang Zuo, Matthieu Besemer, Ad van der Avoird, Gerrit C. Groenenboom, Hua Guo, and Arthur G. Suits
Nat. Sci., 2, e20210074 (2021)
[doi]
[pdf]
- Quantum spin systems versus Schrödinger operators: A case study in spontaneous symmetry breaking
Christiaan J. F. van de Ven, Gerrit C. Groenenboom, Robin Reuvers, and Nicolaas P. Landsman
SciPost Phys., 8, 022 (2020)
[doi]
[pdf]
- Correlations in rotational energy transfer for NO-D2 inelastic collisions
Guoqiang Tang, Matthieu Besemer, Tim de Jongh, Quan Shuai, Ad van der Avoird, Gerrit C. Groenenboom, and Sebastiaan Y. T. van de Meerakker
J. Chem. Phys., 153, 064301 (2020)
[doi]
[pdf]
©
- Experimental and theoretical investigation of resonances in low-energy NO-H2 collisions
Quan Shuai, Tim de Jongh, Matthieu Besemer, Ad van der Avoird, Gerrit Groenenboom, and Sebastiaan van de Meerakker
J. Chem. Phys., 153, 244302 (2020)
[doi]
[arXiv:2010.10146]
[pdf]
©
- Controlling the nature of a charged impurity in a bath of Feshbach dimers
Henrik Hirzler, Eleanor Trimby, Rianne S. Lous, Gerrit C. Groenenboom, Rene Gerritsma, and Jesús Pérez-Ríos
Phys. Rev. Res., 2, 033232 (2020)
[doi]
[arXiv:2005.14625]
[pdf]
- Imaging the onset of the resonance regime in low-energy NO-He collisions
Tim de Jongh, Matthieu Besemer, Quan Shuai, Tijs Karman, Ad van der Avoird, Gerrit C. Groenenboom, and Sebastiaan Y. T. van de Meerakker
Science, 368, 626 (2020)
[doi]
[pdf]
[Supplement]
- Rotational-vibrational resonance states
A. G. Császár, I. Simkó, T. Szidarovszky, G. C. Groenenboom, T. Karman, and A. van der Avoird
Phys. Chem. Chem. Phys., 22, 15081 (2020)
[doi]
[pdf]
- Suppressed and enhanced tunneling ionization of transition-metal atoms and cations: A time-dependent density-funcional-theory study on nickel
Xi Chu and Gerrit C. Groenenboom
Phys. Rev. A, 101, 043423 (2020)
[doi]
[pdf]
- State-to-state scattering of highly vibrationally excited NO at broadly tunable energies: Collision dynamics in a new realm
Chandika Amarasinghe, Hongwei Li, Chatura A. Perera, Matthieu Besemer, Junxiang Zuo, Changjian Xie, Ad van der Avoird, Gerrit C. Groenenboom, Hua Guo, Jacek Kłos, and Arthur G. Suits
Nature Chem., 12, 528 (2020)
[doi]
[https://rdcu.be/b35Xb]
[pdf]
- Lichtabsorptie door botsende O2-moleculen
Tijs Karman, Ad van der Avoird, and Gerrit C. Groenenboom
Nederlands Tijdschrift voor Natuurkunde, 85, 35 (2019)
[http://www.ntvn.nl]
[pdf]
- Update of the HITRAN collision-induced absorption section
Tijs Karman, Iouli E. Gordon, Ad van der Avoird, Yury I. Baranov, Christian Boulet, Brian J. Drouin, Gerrit C. Groenenboom, Magnus Gustafsson, Jean-Michel Hartmann, Robert L. Kurucz, Laurence S. Rothman, Kang Sun, Keeyoon Sung, Ryan Thalman, Ha Tran, Edward H. Wishnow, Robin Wordsworth, Andrey A. Vigasin, Rainer Volkamer, and Wim J. van der Zande
Icarus, 328, 160 (2019)
[doi]
[http://www.sciencedirect.com/science/article/pii/S0019103518306997]
[pdf]
- Photoinduced two-body loss of ultracold molecules
Arthur Christianen, Martin W. Zwierlein, Gerrit C. Groenenboom, and Tijs Karman
Phys. Rev. Lett., 123, 123402 (2019)
[doi]
[pdf]
- Six-dimensional potential energy surface for NaK-NaK collisions: Gaussian Process representation with correct asymptotic form
Arthur Christianen, Tijs Karman, Rodrigo A. Vargas-Hernández, Gerrit C. Groenenboom, and Roman V. Krems
J. Chem. Phys., 150, 064106 (2019)
[doi]
[pdf]
©
- Quasiclassical method for calculating the density of states of ultracold collision complexes
Arthur Christianen, Tijs Karman, and Gerrit C. Groenenboom
Phys. Rev. A, 100, 032708 (2019)
[doi]
[pdf]
- Differential cross sections for State-to-State collisions of NO(v = 10) in near-copropagating beams
Chandika Amarasinghe, Hongwei Li, Chatura A. Perera, Matthieu Besemer, Ad van der Avoird, Gerrit C. Groenenboom, Chengjian Xie, Hua Guo, and Arthur G. Suits
J. Phys. Chem. Lett., 10, 2422 (2019)
[doi]
[pdf]
[Supplement]
- Scattering resonances in bimolecular collisions between NO radicals and H2 challenge the theoretical gold standard
Sjoerd N. Vogels, Tijs Karman, Jacek Kłos, Matthieu Besemer, Jolijn Onvlee, Ad van der Avoird, Gerrit C. Groenenboom, and Sebastiaan Y. T. van de Meerakker
Nature Chem., 10, 435 (2018)
[doi]
[http://rdcu.be/HlDr]
[pdf]
[Supplement]
- Energy dependent parity-pair behavior in NO + He collisions
Jolijn Onvlee, Sjoerd N. Vogels, Tijs Karman, Gerrit C. Groenenboom, Sebastiaan Y. T. van de Meerakker, and Ad van der Avoird
J. Chem. Phys., 149, 084306 (2018)
[doi]
[pdf]
©
- Characterization of methanol as a magnetic field tracer in star-forming regions
Boy Lankhaar, Wouter Vlemmings, Gabriele Surcis, Huib Jan van Langevelde, Gerrit C. Groenenboom, and Ad van der Avoird
Nature Astron., 2, 145 (2018)
[doi]
[http://rdcu.be/FPeB]
[pdf]
[Supplement]
- Erratum: “Hyperfine interactions and internal rotation in methanol” [J. Chem. Phys. 145, 244301 (2016)]
Boy Lankhaar, Gerrit C. Groenenboom, and Ad van der Avoird
J. Chem. Phys., 148, 149901 (2018)
[doi]
[pdf]
©
- O2-O2 and O2-N2 collision-induced absorption mechanisms unravelled
Tijs Karman, Mark A. J. Koenis, Agniva Banerjee, David H. Parker, Iouli E. Gordon, Ad van der Avoird, Wim J. van der Zande, and Gerrit C. Groenenboom
Nature Chem., 10, 549 (2018)
[doi]
[https://rdcu.be/K2fO]
[pdf]
[Supplement]
- Diabatic states, nonadiabatic coupling, and the counterpoise procedure for weakly interacting open-shell molecules
Tijs Karman, Matthieu Besemer, Ad van der Avoird, and Gerrit C. Groenenboom
J. Chem. Phys., 148, 094105 (2018)
[doi]
[pdf]
©
- Observation of correlated excitations in bimolecular collisions
Zhi Gao, Tijs Karman, Sjoerd N. Vogels, Matthieu Besemer, Ad van der Avoird, Gerrit C. Groenenboom, and Sebastiaan Y. T. van de Meerakker
Nature Chem., 10, 469 (2018)
[doi]
[pdf]
[Supplement]
- Correlated energy transfer in rotationally and spin-orbit inelastic collisions of NO(X,2Π1/2,j=1/2 f) with O2(3Σg-)
Zhi Gao, Tijs Karman, Guoqiang Tang, Ad van der Avoird, Gerrit C. Groenenboom, and Sebastiaan Y. T. van de Meerakker
Phys. Chem. Chem. Phys., 20, 12444 (2018)
[doi]
[pdf]
- Potential energy and dipole moment surfaces of the triplet states of the O2(X3Σg-)-O2(X3Σg-,a1Δg,b1Σg+) complex
Tijs Karman, Ad van der Avoird, and Gerrit C. Groenenboom
J. Chem. Phys., 147, 084306 (2017)
[doi]
[pdf]
©
- Line-shape theory of the X3Σg-→ a1Δg,b1Σg+ transitions in O2-O2 collision-induced absorption
Tijs Karman, Ad van der Avoird, and Gerrit C. Groenenboom
J. Chem. Phys., 147, 084307 (2017)
[doi]
[pdf]
©
- State-to-state differential cross sections for inelastic collisions of NO radicals with para-H2 and ortho-D2
Zhi Gao, Sjoerd Vogels, Matthieu Besemer, Tijs Karman, Gerrit C. Groenenboom, Ad van der Avoird, and Sebastiaan Y. T. van de Meerakker
J. Phys. Chem. A, 121, 7446 (2017)
[doi]
[pdf]
- Imaging diffraction oscillations for inelastic collisions of NO radicals with He and D2
Tim de Jongh, Tijs Karman, Sjoerd N. Vogels, Matthieu Besemer, Jolijn Onvlee, Arthur G. Suits, James O. F. Thompson, Gerrit C. Groenenboom, Ad van der Avoird, and Sebastiaan Y. T. van de Meerakker
J. Chem. Phys., 147, 013918 (2017)
[doi]
[pdf]
©
- Tunneling ionization of the 4F and 6D states of vanadium: Exchange blockade
Xi Chu and Gerrit C. Groenenboom
Phys. Rev. A, 96, 013421 (2017)
[doi]
[pdf]
- Stark-interference of electric and magnetic dipole transitions in the A - X band of OH
H. Christian Schewe, Dongdong Zhang, Gerard Meijer, Robert W. Field, Boris G. Sartakov, Gerrit C. Groenenboom, Ad van der Avoird, and Nicolas Vanhaecke
Phys. Rev. Lett., 116, 153001 (2016)
[doi]
[http://link.aps.org/doi/10.1103/PhysRevLett.116.153001]
[pdf]
- Probing scattering resonances in (ultra)cold inelastic NO-He collisions
Jolijn Onvlee, Ad van der Avoird, Gerrit C. Groenenboom, and Sebastiaan Y. T. van de Meerakker
J. Phys. Chem. A, 120, 4770 (2016)
[doi]
[pdf]
- Imaging quantum stereodynamics through Fraunhofer scattering of NO radicals with rare gas atoms
Jolijn Onvlee, Sean D. S. Gordon, Sjoerd N. Vogels, Thomas Auth, Tijs Karman, Bethan Nichols, Ad van der Avoird, Gerrit C. Groenenboom, Mark Brouard, and Sebastiaan Y. T. van de Meerakker
Nature Chem., 9, 226 (2016)
[doi]
[pdf]
[Supplement]
- Hyperfine interactions and internal rotation in methanol
Boy Lankhaar, Gerrit C. Groenenboom, and Ad van der Avoird
J. Chem. Phys., 145, 244301 (2016)
[doi]
[pdf]
[Supplement]
©
- Communication: Multiple-property-based diabatization for open-shell van der Waals molecules
Tijs Karman, Ad van der Avoird, and Gerrit C. Groenenboom
J. Chem. Phys., 144, 121101 (2016)
[doi]
[pdf]
©
- Time-dependent density-functional-theory study of the suppressed tunneling ionization of vanadium
Xi Chu and Gerrit C. Groenenboom
Phys. Rev. A, 94, 053417 (2016)
[doi]
[pdf]
- Contributions of inner valence molecular orbitals and multiphoton resonances to high-order-harmonic generation of N2: A time-dependent density-functional-theory study
Xi Chu and Gerrit C. Groenenboom
Phys. Rev. A, 93, 013422 (2016)
[doi]
[pdf]
- Quantum calculation of inelastic CO collisions with H. II. Pure rotational quenching of high rotational levels
K. M. Walker, L. Song, B. H. Yang, G. C. Groenenboom, A. van der Avoird, N. Balakrishnan, R. C. Forrey, and P. C. Stancil
Astrophys. J., 811, 27 (2015)
[doi]
[pdf]
- Imaging resonances in low-energy NO-He inelastic collisions
Sjoerd N. Vogels, Jolijn Onvlee, Simon Chefdeville, Ad van der Avoird, Gerrit C. Groenenboom, and Sebastiaan Y. T. van de Meerakker
Science, 350, 787 (2015)
[doi]
[arXiv:1510.00299]
[pdf]
[Supplement]
- Direct extraction of alignment moments from inelastic scattering images
Arthur G. Suits, Chandan Kumar Bishwakarma, Lei Song, Gerrit C. Groenenboom, Ad van der Avoird, and David H. Parker
J. Phys. Chem. A, 119, 5925 (2015)
[doi]
[pdf]
- Inelastic Scattering of CO with He: polarization dependent differential state-to-state cross sections
Lei Song, Gerrit C. Groenenboom, Ad van der Avoird, Chandan Kumar Bishwakarma, Gautam Sarma, David H. Parker, and Arthur G. Suits
J. Phys. Chem. A, 119, 12526 (2015)
[doi]
[pdf]
- Quantum calculation of inelastic CO collisions with H. III. Rate coefficients for Ro-vibrational transitions
Lei Song, Naduvalath Balakrishnan, Kyle M. Walker, Phillip C. Stancil, Wing-Fai Thi, Inga Kamp, Ad van der Avoird, and Gerrit C. Groenenboom
Astrophys. J., 813, 96 (2015)
[doi]
[pdf]
- Quantum scattering calculations for ro-vibrational de-excitation of CO by hydrogen atoms
Lei Song, Naduvalath Balakrishnan, Ad van der Avoird, Tijs Karman, and Gerrit C. Groenenboom
J. Chem. Phys., 142, 204303 (2015)
[doi]
[pdf]
©
- Resolving rainbows with superimposed diffraction oscillations in NO + rare gas scattering: experiment and theory
Jolijn Onvlee, Sjoerd N. Vogels, Ad van der Avoird, Gerrit C. Groenenboom, and Sebastiaan Y. T. van de Meerakker
New J. Phys., 17, 055019 (2015)
[doi]
[pdf]
[Supplement]
- Collision-induced absorption with exchange effects and anisotropic interactions: theory and application to H2-H2
Tijs Karman, Ad van der Avoird, and Gerrit C. Groenenboom
J. Chem. Phys., 142, 084305 (2015)
[doi]
[pdf]
©
- Quantum mechanical calculation of the collision-induced absorption spectra of N2-N2 with anisotropic interactions
Tijs Karman, Evangelos Miliordos, Katharine L. C. Hunt, Gerrit C. Groenenboom, and Ad van der Avoird
J. Chem. Phys., 142, 084306 (2015)
[doi]
[pdf]
©
- State-resolved diffraction oscillations imaged for inelastic collisions of NO radicals with He, Ne and Ar
Alexander von Zastrow, Jolijn Onvlee, Sjoerd N. Vogels, Gerrit C. Groenenboom, Ad van der Avoird, and Sebastiaan Y. T. van de Meerakker
Nature Chem., 6, 216 (2014)
[doi]
[pdf]
- High-resolution imaging of velocity-controlled molecular collisions using counterpropagating beams
Sjoerd N. Vogels, Jolijn Onvlee, Alexander von Zastrow, Gerrit C. Groenenboom, Ad van der Avoird, and Sebastiaan Y. T. van de Meerakker
Phys. Rev. Lett., 113, 263202 (2014)
[doi]
[arXiv:1410.0492]
[pdf]
- A renormalized potential-following propagation algorithm for solving the coupled-channels equations
Tijs Karman, Liesbeth M. C. Janssen, Rik Sprenkels, and Gerrit C. Groenenboom
J. Chem. Phys., 141, 064102 (2014)
[doi]
[pdf]
©
- Cold magnetically trapped 2Dg scandium atoms. II. Scattering dynamics
Tijs Karman and Gerrit C. Groenenboom
Phys. Rev. A, 90, 052702 (2014)
[doi]
[pdf]
- Cold magnetically trapped 2Dg scandium atoms. I. Interaction potential
Tijs Karman, Xi Chu, and Gerrit C. Groenenboom
Phys. Rev. A, 90, 052701 (2014)
[doi]
[pdf]
- A theoretical and experimental study of pressure broadening of the oxygen A-band by helium
Dennis L. A. G. Grimminck, Frans R. Spiering, Liesbeth M. C. Janssen, Ad van der Avoird, Wim J. van der Zande, and Gerrit C. Groenenboom
J. Chem. Phys., 140, 204314 (2014)
[doi]
[pdf]
©
- Photodissociation of singlet oxygen in the UV region.
Zahid Farooq, Dmitri Chestakov, Bin Yan, Gerrit C. Groenenboom, Wim J. van der Zande, and David H. Parker
Phys. Chem. Chem. Phys., 16, 3305 (2014)
[doi]
[pdf]
- Line strength of rovibrational and rotational transitions within the X 3Σ- ground state of NH
James S. A. Brooke, Peter F. Bernath, Colin M. Western, Marc C. van Hemert, and Gerrit C. Groenenboom
J. Chem. Phys., 141, 054310 (2014)
[doi]
[pdf]
©
- Three-dimensional ab initio potential energy surface for H-CO(X 2A')
Lei Song, Ad van der Avoird, and Gerrit C. Groenenboom
J. Phys. Chem. A, 117, 7571 (2013)
[doi]
[pdf]
- Quantum reactive scattering of ultracold NH(X,3Σ-) radicals in a magnetic trap
Liesbeth M. C. Janssen, Ad van der Avoird, and Gerrit C. Groenenboom
Phys. Rev. Lett., 110, 063201 (2013)
[doi]
[arXiv:1301.1931]
[pdf]
[Supplement]
- Role of resonance-enhanced multiphoton excitation in high-harmonic generation of N2: A time-dependent density-functional-theory study
Xi Chu and Gerrit C. Groenenboom
Phys. Rev. A, 87, 013434 (2013)
[doi]
[pdf]
- Quantum-state resolved bimolecular collisions of velocity-controlled OH with NO radicals
Moritz Kirste, Xingan Wang, H. Christian Schewe, Gerard Meijer, Kopin Liu, Ad van der Avoird, Liesbeth M. C. Janssen, Koos B. Gubbels, Gerrit C. Groenenboom, and Sebastiaan Y. T. van de Meerakker
Science, 338, 1060 (2012)
[doi]
[arXiv:1210.5947]
[http://www.sciencemag.org/content/338/6110/1060]
[pdf]
[Supplement]
- Communication: Magnetic dipole transitions in the OH A 2Σ+ ← X 2Π system
Moritz Kirste, Xingan Wang, Gerard Meijer, Koos B. Gubbels, Ad van der Avoird, Gerrit C. Groenenboom, and Sebastiaan Y. T. van de Meerakker
J. Chem. Phys., 137, 101102 (2012)
[doi]
[pdf]
[Supplement]
©
- Scattering resonances in slow NH3-He collisions
Koos B. Gubbels, Sebastiaan Y. T. van de Meerakker, Gerrit C. Groenenboom, Gerard Meijer, and A. van der Avoird
J. Chem. Phys., 136, 074301 (2012)
[doi]
[pdf]
©
- Resonances in rotationally inelastic scattering of OH(X2Π) with helium and neon
Koos B. Gubbels, Qianli Ma, Millard Alexander, Paul Dagdigian, Dick Tanis, Gerrit C. Groenenboom, A. van der Avoird, and Sebastiaan Y. T. van de Meerakker
J. Chem. Phys., 136, 144308 (2012)
[doi]
[pdf]
©
- Botsende moleculen
Gerrit C. Groenenboom and Bas van de Meerakker
(2012) dbase/36667-radio-1-labyrint-radio-25-11-2012.mp3;
36667-radio-1-labyrint-radio-25-11-2012.mp3;
pr:ohno pr:cold;
[http://download.omroep.nl/portal/radiomanager/archive/radio1/2012/11/25/36667-radio_1_labyrint_radio_25_11_2012.mp3]
[mp3]
- Time-dependent density-functional-theory calculation of high-order harmonic generation of H2
Xi Chu and Gerrit C. Groenenboom
Phys. Rev. A, 85, 053402 (2012)
[doi]
[pdf]
- Control and imaging of O(1D2) precession
Shiou-Min Wu, Dragana Č. Radenović, Wim J. van der Zande, Gerrit C. Groenenboom, David H. Parker, Claire Vallance, and Richard N. Zare
Nature Chem., 3, 28 (2011)
[doi]
[pdf]
- Scattering of Stark-decelerated OH radicals with rare-gas atoms
Ludwig Scharfenberg, Koos B. Gubbels, Moritz Kirste, Gerrit C. Groenenboom, Ad van der Avoird, Gerard Meijer, and Sebastiaan Y. T. van de Meerakker
Eur. Phys. J. D, 65, 189 (2011)
[doi]
[arXiv:1101.0948]
[pdf]
- Line formation in solar granulation VIII. N I, NH and CN lines and the solar photospheric N abundance
A. J. Sauval, M. Asplund, N. Grevesse, M. C. van Hemert, G. C. Groenenboom, and R. Blomme
Astron. Astrophys., , in preparation (2011)
- Towards the complete experiment: Measurement of S(1D2) polarization in correlation with single rotational states of CO(J) from the photodissociation of oriented OCS(v2=1|JlM=111)
M. Laura Lipciuc, T. Peter Rakitzis, W. Leo Meerts, Gerrit C. Groenenboom, and Maurice H. M. Janssen
Phys. Chem. Chem. Phys., 13, 8549 (2011)
[doi]
[pdf]
- Cold and ultracold NH-NH collisions: The field-free case
Liesbeth M. C. Janssen, Piotr S. Żuchowski, Ad van der Avoird, Jeremy M. Hutson, and Gerrit C. Groenenboom
J. Chem. Phys., 134, 124309 (2011)
[doi]
[arXiv:1012.0804]
[pdf]
©
- Cold and ultracold NH-NH collisions in magnetic fields
Liesbeth M. C. Janssen, Piotr S. Żuchowski, Ad van der Avoird, Gerrit C. Groenenboom, and Jeremy M. Hutson
Phys. Rev. A, 83, 022713 (2011)
[doi]
[arXiv:1012.2814]
[pdf]
- On the role of the magnetic dipolar interaction in cold and ultracold collisions: Numerical and analytical results for NH(3Σ-) + NH(3Σ-)
Liesbeth M. C. Janssen, Ad van der Avoird, and Gerrit C. Groenenboom
Eur. Phys. J. D, 65, 177 (2011)
[doi]
[arXiv:1103.4274]
[pdf]
- Schrödinger vergelijking voor een emmer water
Gerrit C. Groenenboom and Ad van der Avoird
Nederlands Tijdschrift voor Natuurkunde (Special Fysische chemie), 77, 220 (2011)
[http://www.ntvn.nl]
[pdf]
- Product pair correlation in CH3OH photodissociation at 157 nm: the OH+CH3 channel
Zhichao Chen, Andre T. J. B. Eppink, Bo Jiang, Gerrit C. Groenenboom, Xueming Yang, and David H. Parker
Phys. Chem. Chem. Phys., 13, 2350 (2011)
[doi]
[pdf]
- Producing translationally cold, ground-state CO molecules
Janneke H. Blokland, Jens Riedel, Stephan Putzke, Boris G. Sartakov, Gerrit C. Groenenboom, and Gerard Meijer
J. Chem. Phys., 135, 114201 (2011)
[doi]
[arXiv:1109.6203]
[pdf]
©
- Angular momentum polarisation in the O(1D) products of O2 photolysis via the B3Σu- state
Shiou-Min Wu, Dmitri Chestakov, Gerrit C. Groenenboom, Wim J. van der Zande, David H. Parker, Guorong Wu, Xueming Yang, and Claire Vallance
Mol. Phys., 108, 1145 (2010)
[doi]
[pdf]
- NWO Astrochemistry Program
Petra Rudolf, Wim Ubachs, Wybren Jan Buma, Ewine van Dishoeck, Gerrit C. Groenenboom, F. Matthias Bickelhaupt, Harold Linnartz, Xander Tielens, Jos Oomens, Pascale Ehrenfreund, and Ben Feringa (The Netherlands, 2010)
[pdf]
- Water dimer vibration-rotation tunneling levels from vibrationally averaged monomer wavefunctions
R. E. A. Kelly, J. Tennyson, G. C. Groenenboom, and A. van der Avoird
J. Quant. Spectrosc. Radiat. Transfer, 111, 1262 (2010)
[doi]
[pdf]
- Publisher's Note: ``Ab initio potential energy surfaces for NH(3Σ-)-NH(3Σ-) with analytical long range'' [J. Chem. Phys. 131, 224314 (2009)]
Liesbeth M. C. Janssen, Gerrit C. Groenenboom, Ad van der Avoird, Piotr S. Żuchowski, and RafaŁ Podeszwa
J. Chem. Phys., 132, 029902 (2010)
[doi]
[pdf]
©
- Cold and ultracold collisions
Gerrit C. Groenenboom and Liesbeth M. C. Janssen
in: Tutorials in molecular reaction dynamics, edited by M. Brouard and C. Vallance, page 392 (RSC, Cambridge, 2010)
[http://www.rsc.org/Shop/books/2010/9780854041589.asp]
[pdf]
- Erratum: Spin-orbit relaxation of Cl(2P1/2) and F(2P1/2) in a gas of H2
Erik Abrahamsson, Gerrit C. Groenenboom, and Roman V. Krems
J. Chem. Phys., 133, 109902 (2010)
[doi]
[pdf]
©
- Dynamics of OH(2Π)-He collisions in combined electric and magnetic fields
Timur V. Tscherbul, Gerrit C. Groenenboom, Roman V. Krems, and Alexander Dalgarno
Faraday Discuss., 142, 127 (2009)
[doi]
[arXiv:0811.4018]
[http://www.rsc.org/ConferencesAndEvents/RSCConferences/FD142/index.asp]
[pdf]
- Photodissociation dynamics of the A2Σ+ state of SH and SD radicals
Rebecca A. Rose, Andrew J. Orr-Ewing, Chung-Hsin Yang, Konstantin Vidma, Gerrit C. Groenenboom, and David H. Parker
J. Chem. Phys., 130, 034307 (2009)
[doi]
[pdf]
©
- Predissociation of the A 2Σ+ (v'=3) state of the OH radical
Dragana Č. Radenović, André J. A. van Roij, Shiou-Min Wu, J. J. ter Meulen, David H. Parker, Mark P. J. van der Loo, and Gerrit C. Groenenboom
Phys. Chem. Chem. Phys., 11, 4754 (2009)
[doi]
[pdf]
- Cold collisions of OH(2Π) molecules with He atoms in external fields
Zoran Pavlovic, Timur V. Tscherbul, Hossein R. Sadeghpour, Gerrit C. Groenenboom, and Alex Dalgarno
J. Phys. Chem. A, 113, 14670 (2009)
[doi]
[pdf]
- Ab initio potential energy surfaces for NH (3Σ-) - NH (3Σ-) with analytical long range
Liesbeth M. C. Janssen, Gerrit C. Groenenboom, Ad van der Avoird, Piotr S. Żuchowski, and Rafał Podeszwa
J. Chem. Phys., 131, 224314 (2009)
[doi]
[pdf]
©
- Bound states of the OH(2Π)-HCl complex on ab initio diabatic potentials
Gerrit C. Groenenboom, Anna V. Fishchuk, and A. van der Avoird
J. Chem. Phys., 131, 124307 (2009)
[doi]
[pdf]
©
- Photodissociation imaging of diatomic sulfur (S2)
Pim W. J. M. Frederix, Chung-Hsin Yang, Gerrit C. Groenenboom, David H. Parker, Koutayba Alnama, Colin M. Western, and Andrew J. Orr-Ewing
J. Phys. Chem. A, 113, 14995 (2009)
[doi]
[pdf]
- Correlated fine structure branching ratios arising from state-selected predissociation of ClO (A2Π3/2)
Kristin S. Dooley, Michael P. Grubb, Justine Geidosch, Marloes A. van Beek, Gerrit C. Groenenboom, and Simon W. North
Phys. Chem. Chem. Phys., 11, 4770 (2009)
[doi]
[pdf]
- Linear response time dependent density functional theory for dispersion coefficients between atomic pairs
Xi Chu and Gerrit C. Groenenboom
in: Proceedings of the Dalgarno celebratory symposium, edited by J. F. Babb, K. Kirby, and H. Sadeghpour, 56-65 (World Scientific, Singapore, 2009,)
[http://www.amazon.com/Proceedings-Dalgarno-Celebratory-Symposium-Contributions/dp/1848164696/ref=sr_1_1?ie=UTF8&s=books&qid=1262739420&sr=1-1]
[pdf]
- Erratum: ``Theoretical transition probabilities for the OH Meinel system'' [J. Chem. Phys. 126, 114314 (2007)]
Mark P. J. van der Loo and Gerrit C. Groenenboom
J. Chem. Phys., 128, 159902 (2008)
[doi]
[pdf]
©
- New ab initio potential energy surface and the vibration-rotation-tunneling levels of (H2O)2 and (D2O)2
X. Huang, B. J. Braams, J. M. Bowman, R. E. A. Kelly, J. Tennyson, G. C. Groenenboom, and A. van der Avoird
J. Chem. Phys., 128, 034312 (2008)
[doi]
[pdf]
©
- Time-domain measurement of spontaneous vibrational decay of magnetically trapped NH
Wesley C. Campbell, Gerrit C. Groenenboom, Hsin-I Lu, Edem Tsikata, and John M. Doyle
Phys. Rev. Lett., 100, 083003 (2008)
[doi]
[pdf]
- Polarizable interaction potential for water from coupled cluster calculations. II. Applications to dimer spectra, virial coefficients, and simulations of liquid water
R. Bukowski, K. Szalewicz, G. C. Groenenboom, and A. van der Avoird
J. Chem. Phys., 128, 094314 (2008)
[doi]
[pdf]
©
- Polarizable interaction potential for water from coupled cluster calculations. I. Analysis of dimer potential energy surface
R. Bukowski, K. Szalewicz, G. C. Groenenboom, and A. van der Avoird
J. Chem. Phys., 128, 094313 (2008)
[doi]
[pdf]
©
- Photodissociation of vibrationally excited OH/OD radicals
Dragana Č. Radenović, André J. A. van Roij, Shiou-Min Wu, J. J. ter Meulen, David H. Parker, Mark P. J. van der Loo, Liesbeth M. C. Janssen, and Gerrit C. Groenenboom
Mol. Phys., 106, 557 (2008)
[doi]
[pdf]
- Erratum: `` Ab initio computed diabatic potential energy surfaces of OH-HCl'' [J. Chem. Phys. 122, 244325 (2005)]
Paul E. S. Wormer, Jacek A. Kłos, Gerrit C. Groenenboom, and Ad van der Avoird
J. Chem. Phys., 126, 079902 (2007)
[doi]
[pdf]
©
- Theoretical transition probabilities for the OH Meinel system
Mark P. J. van der Loo and Gerrit C. Groenenboom
J. Chem. Phys., 126, 114314 (2007)
[doi]
[pdf]
©
- De geheimen van water ontdekken op de computer
Ad van der Avoird and Gerrit C. Groenenboom
NWO Chemische Wetenschappen Nieuwsbrief, juni, 7 (2007)
[pdf]
- Photodissociation of vibrationally excited SH and SD radicals at 288 and 291 nm: The S(1D2) channel
Liesbeth M. C. Janssen, Mark P. J. van der Loo, Gerrit C. Groenenboom, Shiou-Min Wu, Dragana Č. Radenović, André J. A. van Roij, Ivan Anton Garcia, and David H. Parker
J. Chem. Phys., 126, 094304 (2007)
[doi]
[pdf]
©
- Eigenschappen van water berekend
Gerrit C. Groenenboom
(2007) dbase/20070302-21.mp3;
20070302-21.mp3;
pr:water;
[http://www.wetenschap24.nl/programmas/hoezo-radio.html]
[mp3]
- Electronic anisotropy between open shell atoms in first and second order perturbation theory
Gerrit C. Groenenboom, Xi Chu, and Roman V. Krems
J. Chem. Phys., 126, 204306 (2007)
[doi]
[pdf]
©
- The radiative lifetime of metastable CO (a3Π, v=0)
Joop J. Gilijamse, Steven Hoekstra, Samuel A. Meek, Markus Metsälä, Sebastiaan Y. T. van de Meerakker, Gerard Meijer, and Gerrit C. Groenenboom
J. Chem. Phys., 127, 221102 (2007)
[doi]
[arXiv:0710.2240]
[pdf]
©
- Ab initio treatment of the chemical reaction precursor complex Br(2P)-HCN; 2. Bound state calculations and infrared spectra
Anna V. Fishchuk, Jeremy M. Merritt, Gerrit C. Groenenboom, and Ad van der Avoird
J. Phys. Chem. A, 111, 7270 (2007)
[doi]
[pdf]
- Dynamic polarizabilities of rare earth atoms and dispersion coefficients for their interaction with helium atoms
Xi Chu, Alexander Dalgarno, and Gerrit C. Groenenboom
Phys. Rev. A, 75, 032723 (2007)
[doi]
[pdf]
- Predictions of the properties of water from first principles
R. Bukowski, K. Szalewicz, G. C. Groenenboom, and A. van der Avoird
Science, 315, 1249 (2007)
[doi]
[http://www.sciencemag.org/cgi/content/abstract/315/5816/1249]
[pdf]
- (2+1)REMPI on molecular nitrogen through the 1Σg+ (II)-state
J. Bominaar, C. Schoemaecker, N. Dam, J. J. ter Meulen, and G. C. Groenenboom
Chem. Phys. Lett., 435, 242 (2007)
[doi]
[pdf]
- Spin-orbit relaxation of Cl(2P1/2) and F(2P1/2) in a gas of H2
Erik Abrahamsson, Gerrit C. Groenenboom, and Roman V. Krems
J. Chem. Phys., 126, 184303 (2007)
[doi]
[pdf]
©
- Raman association of H2 in the early universe
Mark P. J. van der Loo, Gerrit C. Groenenboom, Michael J. Jamieson, and Alex Dalgarno
Proc. R. Soc. Faraday Discuss., 133, 43 (2006)
[doi]
[pdf]
- Vibrational state-dependent predissociation dynamics of ClO (A 2Π3/2): Insight from correlated fine structure branching ratios
Hahkjoon Kim, Kristin S. Dooley, Gerrit C. Groenenboom, and Simon W. North
Phys. Chem. Chem. Phys., 8, 2964 (2006)
[doi]
[pdf]
- Near-threshold inelastic collisions using moleculear beams with a tunable velocity
Joop J. Gilijamse, Steven Hoekstra, Sebastiaan Y. T. van de Meerakker, Gerrit C. Groenenboom, and Gerard Meijer
Science, 313, 1617 (2006)
[doi]
[http://www.sciencemag.org/cgi/content/abstract/313/5793/1617]
[pdf]
[Supplement]
- Ab initio treatment of the chemical reaction precursor complex Cl(2P)-HF; 2. Bound states and spectrum
Anna V. Fishchuk, Gerrit C. Groenenboom, and Ad van der Avoird
J. Phys. Chem. A, 110, 5280 (2006)
[doi]
[pdf]
- Photolysis of NO2 at multiple wavelengths in the spectral region 200-205 nm: a velocity map imaging study
A. M. Coroiu, David H. Parker, Gerrit C. Groenenboom, Jonathan Barr, Inmaculada Torres Novalbos, and Benjamin J. Whitaker
Eur. Phys. J. D, 38, 151 (2006)
[doi]
[pdf]
- Interaction potential for water dimer from symmetry-adapted perturbation theory based on density functional description of monomers
R. Bukowski, K. Szalewicz, G. C. Groenenboom, and A. van der Avoird
J. Chem. Phys., 125, 044301 (2006)
[doi]
[pdf]
©
- The photodissociation dynamics of ozone at 193 nm: an O(1D2) angular momentum polarization study
M. Brouard, R. Cireasa, A. P. Clark, G. C. Groenenboom, G. Hancock, S. J. Horrocks, F. Quadrini, G. A. D. Ritchie, and C. Vallance
J. Chem. Phys., 125, 133308 (2006)
[doi]
[pdf]
©
- Ab initio computed diabatic potential energy surfaces of OH-HCl
Paul E. S. Wormer, Jacek A. Kłos, Gerrit C. Groenenboom, and Ad van der Avoird
J. Chem. Phys., 122, 244325 (2005)
[doi]
[pdf]
©
- Ab initio potential energy surface for the reaction Ca + HCl → CaCl + H
G. Verbockhaven, C. Sanz, G. C. Groenenboom, O. Roncero, and A. van der Avoird
J. Chem. Phys., 122, 204307 (2005)
[doi]
[pdf]
©
- Lecture: Introduction to time-independent scattering theory
Mark P. J. van der Loo and Gerrit C. Groenenboom (Nijmegen, 2005)
[pdf]
- Ab initio calculation of (2+1) REMPI spectra and lifetimes of the (D, 3) 2Σ- states of OH and OD
Mark P. J. van der Loo and Gerrit C. Groenenboom
J. Chem. Phys., 123, 074310 (2005)
[doi]
[pdf]
[Supplement]
©
- Direct measurement of the radiative lifetime of vibrationally excited OH radicals
Sebastiaan Y. T. van de Meerakker, Nicolas Vanhaecke, Mark P. J. van der Loo, Gerrit C. Groenenboom, and Gerard Meijer
Phys. Rev. Lett., 95, 013003 (2005)
[doi]
[arXiv:physics/0505097]
[pdf]
- Imaging atomic orbital polarisation in molecular photodissociation
Claire Vallance, Mark Brouard, Raluca Cireasa, Andrew P. Clark, Fabio Quadrini, Gerrit C. Groenenboom, and Oleg S. Vasyutinskii
in: Vector Correlation and Alignment in Chemistry, edited by G. G. Balint-Kurti and M. P. de Miranda, page 29 (Collaborative computational project on molecular quantum dynamics (CCP6), Daresbury, United Kingdom, 2005)
[http://www.ccp6.ac.uk]
[pdf]
- Experimental and theoretical investigation of the A 3Π - X 3Σ- transition of NH/D-Ne
G. Kerenskaya, U. Schnupf, M. C. Heaven, A. van der Avoird, and G. C. Groenenboom
Phys. Chem. Chem. Phys., 7, 846 (2005)
[doi]
[pdf]
- Lecture: Quantum electrodynamics: one- and two-photon processes
Gerrit C. Groenenboom (Nijmegen, 2005)
[pdf]
- Electrostatic long range effects on photofragment polarization
Gerrit C. Groenenboom
in: Vector Correlation and Alignment in Chemistry, edited by G. G. Balint-Kurti and M. P. de Miranda, page 44 (Collaborative computational project on molecular quantum dynamics (CCP6), Daresbury, United Kingdom, 2005)
[http://www.ccp6.ac.uk]
[pdf]
- Ab initio calculation of the NH(3Σ-)-NH(3Σ-) interaction potentials in the quintet, triplet, and singlet states
Guillaume S. F. Dhont, Joop H. van Lenthe, Gerrit C. Groenenboom, and Ad van der Avoird
J. Chem. Phys., 123, 184302 (2005)
[doi]
[pdf]
©
- Interaction of NH(X3Σ-)with He: potential energy surface, bound states and collisional Zeeman relaxation
H. Cybulski, R. V. Krems, H. R. Sadeghpour, A. Dalgarno, J. Kłos, G. C. Groenenboom, A. van der Avoird, D. Zgid, and G. Chałasiński
J. Chem. Phys., 122, 094307 (2005)
[doi]
[pdf]
©
- Polarizabilities of Sc and Ti atoms and dispersion coefficients for their interaction with helium atoms
Xi Chu, Alexander Dalgarno, and Gerrit C. Groenenboom
Phys. Rev. A, 72, 032703 (2005)
[doi]
[pdf]
- Erratum: Bound states of the Cl(2P)-HCl van der Waals complex from coupled ab initio potential energy surfaces
W. B. Zeimen, J. Kłos, G. C. Groenenboom, and A. van der Avoird
J. Phys. Chem. A, 108, 9319 (2004)
[doi]
[pdf]
- Vibrational predissociation in the HCl dimer
G. W. M. Vissers, L. Oudejans, R. E. Miller, G. C. Groenenboom, and A. van der Avoird
J. Chem. Phys., 120, 9487 (2004)
[doi]
[pdf]
©
- New applications of the genetic algorithm for the interpretation of high resolution spectra
W. Leo Meerts, Michael Schmitt, and Gerrit C. Groenenboom
Can. J. Chem., 82, 804 (2004)
[doi]
[pdf]
- Electronic interaction anisotropy between atoms in arbitrary angular momentum states
R. V. Krems, G. C. Groenenboom, and A. Dalgarno
J. Phys. Chem. A, 108, 8941 (2004)
[doi]
[pdf]
- Rotation operator formalism for open shell complexes
G. C. Groenenboom and A. van der Avoird
in: Quantum Dynamics at Conical Intersections, edited by S. C. Althorpe and G. A. Worth, page 98 (Collaborative computational project on molecular quantum dynamics (CCP6), Daresbury, United Kingdom, 2004)
[http://www.ccp6.ac.uk]
[pdf]
- Lecture: Introduction to time-independent scattering theory
Gerrit C. Groenenboom (Nijmegen, 2004)
[pdf]
- Theoretical study of the He-HF+ complex; II. Rovibronic states from coupled diabatic potential energy surfaces
G. Dhont, W. B. Zeimen, G. C. Groenenboom, and A. van der Avoird
J. Chem. Phys., 120, 103 (2004)
[doi]
[pdf]
©
- Rovibronic spectroscopy of the van der Waals complex He-HCl+
G. Dhont, G. Chambaud, G. C. Groenenboom, and A. van der Avoird
Mol. Phys., 102, 2285 (2004)
[doi]
[pdf]
- Steric asymmetry and Λ-doublet propensities in state-to-state rotationally inelastic scattering of NO(2Π1/2) with He
Marc J. L. de Lange, Steven Stolte, Craig A. Taatjes, Jacek Kłos, Gerrit C. Groenenboom, and Ad van der Avoird
J. Chem. Phys., 121, 11691 (2004)
[doi]
[pdf]
©
- O(3PJ) alignment from the photodissociation of SO2 at 193 nm
M. Brouard, R. Cireasa, A. P. Clark, T. J. Preston, C. Vallance, G. C. Groenenboom, and O. S. Vasyutinskii
J. Phys. Chem. A, 108, 7965 (2004)
[doi]
[pdf]
- Diabatic intermolecular potentials and bound states of open-shell atom - molecule dimers: application to the F(2P)-H2 complex
W. B. Zeimen, J. Kłos, G. C. Groenenboom, and A. van der Avoird
J. Chem. Phys., 118, 7340 (2003)
[doi]
[pdf]
©
- Bound states of the Cl(2P)-HCl van der Waals complex from coupled ab initio potential energy surfaces
W. B. Zeimen, J. Kłos, G. C. Groenenboom, and A. van der Avoird
J. Phys. Chem. A, 107, 5110 (2003)
[doi]
[pdf]
- Singlet-triplet excitation spectrum of the CO-He complex; I: Potential surfaces and bound-bound CO(a3Π ← X1Σ+) transitions
W. B. Zeimen, G. C. Groenenboom, and A. van der Avoird
J. Chem. Phys., 119, 131 (2003)
[doi]
[pdf]
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- Singlet-triplet excitation spectrum of the CO-He complex; II: Photodissociation and bound-free CO(a3Π ← X1Σ+) transitions
W. B. Zeimen, G. C. Groenenboom, and A. van der Avoird
J. Chem. Phys., 119, 141 (2003)
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- Spectrum and vibrational predissociation of the HF dimer. II. Photodissociation cross sections and product state distributions
G. W. M. Vissers, G. C. Groenenboom, and A. van der Avoird
J. Chem. Phys., 119, 286 (2003)
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- Spectrum and vibrational predissociation of the HF dimer. I. Bound and quasi-bound states
G. W. M. Vissers, G. C. Groenenboom, and A. van der Avoird
J. Chem. Phys., 119, 277 (2003)
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- Photodissociation of the OD radical at 226 and 243 nm
D. Č. Radenović, A. J. A. van Roij, D. A. Chestakov, A. T. J. B. Eppink, J. J. ter Meulen, D. H. Parker, M. P. J. van der Loo, G. C. Groenenboom, M. E. Greenslade, and M. I. Lester
J. Chem. Phys., 119, 9341 (2003)
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- Spin-flipping transitions in 2Σ molecules induced by collisions with structureless atoms
R. V. Krems, A. Dalgarno, N. Balakrishnan, and G. C. Groenenboom
Phys. Rev. A, 67, 060703 (2003)
[doi]
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- Adiabatic and diabatic intermolecular potentials for open-shell complexes and their applications
J. Kłos, W. B. Zeimen, V. Lotrich, G. C. Groenenboom, and A. van der Avoird
in: High accuracy potentials for quantum dynamics, edited by A. Miani, J. Tennyson, and T. van Mourik, page 59 (Collaborative computational project on molecular quantum dynamics (CCP6), Daresbury, United Kingdom, 2003)
[http://www.ccp6.ac.uk]
[pdf]
- The He-CaH (2Σ+) interaction. I. Three-dimensional ab initio potential energy surface
G. C. Groenenboom and N. Balakrishnan
J. Chem. Phys., 118, 7380 (2003)
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- Competition between photodetachment and photodissociation in O2-
Laura Dinu, Gerrit C. Groenenboom, and Wim J. van der Zande
J. Chem. Phys., 119, 8864 (2003)
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- The He-CaH (2Σ+) interaction. II. Collisions at cold and ultracold temperatures
N. Balakrishnan, G. C. Groenenboom, R. V. Krems, and A. Dalgarno
J. Chem. Phys., 118, 7386 (2003)
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- Reassignment of the O2 spectrum just below dissociation threshold based on ab initio calculations
M. C. G. N. van Vroonhoven and G. C. Groenenboom
J. Chem. Phys., 117, 5240 (2002)
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- Photodissociation of O2 in the Herzberg continuum II. Calculation of fragment polarization and angular distribution
M. C. G. N. van Vroonhoven and G. C. Groenenboom
J. Chem. Phys., 116, 1965 (2002)
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- Photodissociation of O2 in the Herzberg continuum I. Ab initio calculation of potential energy curves and properties
M. C. G. N. van Vroonhoven and G. C. Groenenboom
J. Chem. Phys., 116, 1954 (2002)
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- Ab initio prediction of the vibration-rotation-tunneling spectrum of HCl-(H2O)2
P. E. S. Wormer, G. C. Groenenboom, and A. van der Avoird
J. Chem. Phys., 115, 3604 (2001)
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- Vibrations, tunneling, and transition dipole moments in the water dimer
M. J. Smit, G. C. Groenenboom, P. E. S. Wormer, A. van der Avoird, R. Bukowski, and K. Szalewicz
J. Phys. Chem. A, 105, 6212 (2001)
[doi]
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- Lecture: Discrete variable representations
Gerrit C. Groenenboom (Nijmegen, 2001)
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- State-to-state photodynamics of nitrous oxide and the effect of long-range interaction on the alignment of O(1D2)
J. M. Teule, G. C. Groenenboom, D. W. Neyer, D. W. Chandler, and M. H. M. Janssen
Chem. Phys. Lett., 320, 177 (2000)
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- Water pair potential of near spectroscopic accuracy: I. Analysis of potential surface and virial coefficients
E. M. Mas, R. Bukowski, K. Szalewicz, G. C. Groenenboom, P. E. S. Wormer, and A. van der Avoird
J. Chem. Phys., 113, 6687 (2000)
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- Imaging of state-to-state photodynamics of nitrous oxide in the 205 nm region of the stratospheric solar window
M. H. M. Janssen, J. M. Teule, D. W. Neyer, D. W. Chandler, and G. C. Groenenboom
in: Atomic and Molecular Beams, edited by R. Campargue, page 317 (Springer, New York, 2000)
[http://www.springer.com/physics/atoms/book/978-3-540-67378-1]
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- Water pair potential of near spectroscopic accuracy: II. Vibration-rotation-tunneling levels of the water dimer
G. C. Groenenboom, P. E. S. Wormer, A. van der Avoird, E. M. Mas, R. Bukowski, and K. Szalewicz
J. Chem. Phys., 113, 6702 (2000)
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- Three-dimensional ab initio potential energy surface for He-O2
G. C. Groenenboom and I. M. Struniewicz
J. Chem. Phys., 113, 9562 (2000)
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- Water pair and three-body potential of spectroscopic quality from ab initio calculations
G. C. Groenenboom, E. M. Mas, R. Bukowski, K. Szalewicz, P. E. S. Wormer, and A. van der Avoird
Phys. Rev. Lett., 84, 4072 (2000)
[doi]
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- Lecture: Angular momentum theory
Gerrit C. Groenenboom (Nijmegen, 1999)
[pdf]
- Discrete variational quantum reactive scattering method with optimal distorted waves. I. Theory
G. C. Groenenboom
J. Chem. Phys., 108, 5670 (1998)
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- Discrete variational quantum reactive scattering method with optimal distorted waves. II. Application to the reaction H+O2 → OH+O
G. C. Groenenboom
J. Chem. Phys., 108, 5677 (1998)
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- Entrance channel effects in the reaction of aligned Ca(1 P) with HCl
A. J. H. M. Meijer, G. C. Groenenboom, and A. van der Avoird
J. Phys. Chem. A, 101, 7558 (1997)
[doi]
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- He-HF scattering cross sections from an ab initio SAPT potential; confrontation with experiment
R. Moszynski, F. de Weerd, G. C. Groenenboom, and A. van der Avoird
Chem. Phys. Lett., 263, 107 (1996)
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- Semiclassical calculations on the energy dependence of the steric effect for the reactions Ca(1 D) + CH3X (jkm = 111) → CaX + CH3 with X = F, Cl, Br
A. J. H. M. Meijer, G. C. Groenenboom, and A. van der Avoird
J. Phys. Chem., 100, 16072 (1996)
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- Semiclassical calculations on the energy dependence of the steric effect for the reaction Ca(1 D) + CH3F (jkm = 111) → CaF + CH3
A. J. H. M. Meijer, G. C. Groenenboom, and A. van der Avoird
J. Chem. Phys., 105, 2247 (1996)
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- On the energy dependence of the steric effect for atom-molecule reactive scattering (II): the reaction Ca(1 D) + CH3F (JKM = 111) → CaF (2Π ) + CH3
A. J. H. M. Meijer, G. C. Groenenboom, and A. van der Avoird
J. Chem. Phys., 101, 7603 (1994)
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- On the energy-dependence of the steric effect in atom-molecule reactive scattering (I): a quasiclassical approach
G. C. Groenenboom and A. J. H. M. Meijer
J. Chem. Phys., 101, 7592 (1994)
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- Lecture: Sparse matrices in quantum chemistry
Gerrit C. Groenenboom and Guillaume S. F. Dhont (Nijmegen, 1993)
[https://www.theochem.ru.nl/cgi-bin/dbase/search.cgi?groenenboom:93a]
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- Combining the discrete variable representation with the S-matrix Kohn method for quantum reactive scattering
Gerrit C. Groenenboom and Daniel T. Colbert
J. Chem. Phys., 99, 9681 (1993)
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- State-to-state reaction probabilities for H-+H2, D2 collisions
A. K. Belyaev, D. T. Colbert, G. C. Groenenboom, and W. H. Miller
Chem. Phys. Lett., 209, 309 (1993)
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- On the eigen-values of the s-state radial equation of a spiked harmonic oscillator
W. Solano-Torres, G. A. Estevéz, F. M. Fernandéz, and G. C. Groenenboom
J. Phys. A, 25, 3427 (1992)
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- NWO report on the application of the discrete variable representation to the S-matrix version of the kohn variational principle for quantum reactive scattering calculations
Gerrit C. Groenenboom (Nijmegen, 1992)
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- CEPA-type size consistency corrections for MRSDCI calculations, MRCEPA
P. J. A. Ruttink, J. H. van Lenthe, R. Zwaans, and G. C. Groenenboom
J. Chem. Phys., 94, 7212 (1991)
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- Novel approaches to the calculation of the electronic strcuture and dynamics of excited states; application to Trans-di-imide and ethylene
G. C. Groenenboom
, Ph. D. thesis
(Technical University of Eindhoven, 1991)
[http://library.tue.nl/catalog/LinkToVubis.csp?DataBib=6:348362]
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- Solving the time-independent Schrödinger equation with the Lanczos procedure
G. C. Groenenboom and H. M. Buck
J. Chem. Phys., 92, 4374 (1990)
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- Semiclassical calculation of the vibrational structure of the B 1Bu Rydberg state of trans-di-imide from ab initio configuration interaction potential energy surfaces
G. C. Groenenboom, J. H. van Lenthe, and H. M. Buck
J. Chem. Phys., 91, 3027 (1989)
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- Quantum chemical study on the mechanism of cis-trans isomerization in retinal-like protonated schiff bases
G. J. M. Dormans, G. C. Groenenboom, W. C. A. van Dorst, and H. M. Buck
J. Am. Chem. Soc., 110, 1406 (1988)
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- Dynamical calculations on the photoisomerization of small polyenes in a nonadiabatic formalism
G. J. M. Dormans, G. C. Groenenboom, and H. M. Buck
J. Chem. Phys., 86, 4895 (1987)
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