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Publication details

Document type
Journal articles

Document subtype
Full paper

Title
Evaluation of the OPLS-AA Force Field for the Study of Structural and Energetic Aspects of Molecular Organic Crystals

Participants in the publication
Carlos E. S. Bernardes (Author)
Dep. Química e Bioquímica
 Dep. Química e Bioquímica
 CQB
 CQE
 Abhinav Joseph (Author)

Date of Publication
2015-03-13

Where published
The Journal of Physical Chemistry A

Publication Identifiers
ISSN - 1089-5639

Publisher
American Chemical Society (ACS)

Volume
119
Number
12

Number of pages
11
Starting page
3023
Last page
3034

Document Identifiers
DOI - https://doi.org/10.1021/jp512349r
URL - http://dx.doi.org/10.1021/jp512349r


Export

APA
Carlos E. S. Bernardes, Abhinav Joseph, (2015). Evaluation of the OPLS-AA Force Field for the Study of Structural and Energetic Aspects of Molecular Organic Crystals. The Journal of Physical Chemistry A, 119, 3023-3034. ISSN 1089-5639. eISSN . http://dx.doi.org/10.1021/jp512349r

IEEE
Carlos E. S. Bernardes, Abhinav Joseph, "Evaluation of the OPLS-AA Force Field for the Study of Structural and Energetic Aspects of Molecular Organic Crystals" in The Journal of Physical Chemistry A, vol. 119, pp. 3023-3034, 2015. 10.1021/jp512349r

BIBTEX
@article{49316, author = {Carlos E. S. Bernardes and Abhinav Joseph}, title = {Evaluation of the OPLS-AA Force Field for the Study of Structural and Energetic Aspects of Molecular Organic Crystals}, journal = {The Journal of Physical Chemistry A}, year = 2015, pages = {3023-3034}, volume = 119 }