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Cybulski, Hubert, Henriksen, Christian, Fernández, Berta (2015) Theoretical Study of the Pyridine–Helium van der Waals Complexes. The Journal of Physical Chemistry A, 119 (44). 10999-11006 doi:10.1021/acs.jpca.5b08492

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Reference TypeJournal (article/letter/editorial)
TitleTheoretical Study of the Pyridine–Helium van der Waals Complexes
JournalThe Journal of Physical Chemistry A
AuthorsCybulski, HubertAuthor
Henriksen, ChristianAuthor
Fernández, BertaAuthor
Year2015 (November 5)Volume119
Issue44
PublisherAmerican Chemical Society (ACS)
DOIdoi:10.1021/acs.jpca.5b08492Search in ResearchGate
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Mindat Ref. ID3965553Long-form Identifiermindat:1:5:3965553:0
GUID0
Full ReferenceCybulski, Hubert, Henriksen, Christian, Fernández, Berta (2015) Theoretical Study of the Pyridine–Helium van der Waals Complexes. The Journal of Physical Chemistry A, 119 (44). 10999-11006 doi:10.1021/acs.jpca.5b08492
Plain TextCybulski, Hubert, Henriksen, Christian, Fernández, Berta (2015) Theoretical Study of the Pyridine–Helium van der Waals Complexes. The Journal of Physical Chemistry A, 119 (44). 10999-11006 doi:10.1021/acs.jpca.5b08492
In(2015, November) The Journal of Physical Chemistry A Vol. 119 (44) American Chemical Society (ACS)

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Cybulski, Hubert, Fernández, Berta (2012) Ab Initio Ground- and Excited-State Intermolecular Potential Energy Surfaces for the NO–Ne and NO–Ar van der Waals Complexes. The Journal of Physical Chemistry A, 116 (27). 7319-7328 doi:10.1021/jp303573a
Cybulski, Hubert, Baranowska-Łączkowska, Angelika, Henriksen, Christian, Fernández, Berta (2014) Small and Efficient Basis Sets for the Evaluation of Accurate Interaction Energies: Aromatic Molecule–Argon Ground-State Intermolecular Potentials and Rovibrational States. The Journal of Physical Chemistry A, 118 (44). 10288-10297 doi:10.1021/jp508317z
Cybulski, Hubert, Fernández, Berta, Henriksen, Christian, Felker, Peter M. (2012) Ab initio ground state phenylacetylene–argon intermolecular potential energy surface and rovibrational spectrum. The Journal of Chemical Physics, 137 (7). 74305pp. doi:10.1063/1.4742153
Cybulski, Hubert, Henriksen, Christian, Dawes, Richard, Wang, Xiao-Gang, Bora, Neha, Avila, Gustavo, Carrington, Tucker, Fernández, Berta (2018) Ab initio study of the CO–N2 complex: a new highly accurate intermolecular potential energy surface and rovibrational spectrum. Physical Chemistry Chemical Physics, 20 (18). 12624-12636 doi:10.1039/c8cp01373j
Fernández, Berta, Henriksen, Christian, Farrelly, David (2013) Refined ab initio intermolecular ground-state potential energy surface for the He–C2H2 van der Waals complex. Molecular Physics, 111. 1173-1177 doi:10.1080/00268976.2013.793837
Rey-Villaverde, Ringo, Cybulski, Hubert, Flores, Jesús R., Fernández, Berta (2013) A high-accuracy theoretical study of the CHnP Systemsn = 1-3. Journal of Computational Chemistry, 34 (23). 2020-2031 doi:10.1002/jcc.23357
Baranowska-Łączkowska, Angelika, Łączkowski, Krzysztof Z., Henriksen, Christian, Fernández, Berta (2018) New Basis Set for the Evaluation of Specific Rotation in Flexible Biological Molecules in Solution. The Journal of Physical Chemistry A, 122 (24). 5477-5483 doi:10.1021/acs.jpca.8b03320
Alharzali, Nissrin, Berriche, Hamid, Villarreal, Pablo, Prosmiti, Rita (2019) Theoretical Study of Cationic Alkali Dimers Interacting with He: Li2+–He and Na2+–He van der Waals Complexes. The Journal of Physical Chemistry A, 123 (36). 7814-7821 doi:10.1021/acs.jpca.9b05551
Munteanu, Cristian R., Henriksen, Christian, Felker, Peter M, Fernández, Berta (2013) He–, Ne–, and Ar–Phosgene Intermolecular Potential Energy Surfaces. The Journal of Physical Chemistry A, 117 (18). 3835-3843 doi:10.1021/jp3110024
Pedersen, Thomas Bondo, Fernández, Berta, Koch, Henrik, Makarewicz, Jan (2001) The helium–, neon–, and argon–cyclopropane van der Waals complexes: Ab initio ground state intermolecular potential energy surfaces and intermolecular dynamics. The Journal of Chemical Physics, 115 (18). 8431-8439 doi:10.1063/1.1398102
Rayón, V. M., Sordo, J. A. (1997) Van der Waals Complexes between Boron Trifluoride and Carbon Monoxide:  A Theoretical Study. The Journal of Physical Chemistry A, 101 (40). 7414-7419 doi:10.1021/jp971289i
 
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