Article citationsMore>>
M. J. Frisch, G. W. Trucks, H. B. Schlegel, G. E. Scuseria, M. A. Robb, J. R. Cheeseman, G. Scalmani, V. Barone, B. Mennucci, G. A. Petersson, H. Nakatsuji, M. Caricato, X. Li, H. P. Hratchian, A. F. Izmaylov, J. Bloino, G. Zheng, J. L. Sonnenberg, M. Hada, M. Ehara, K. Toyota, R. Fukuda, J. Hasegawa, M. Ishida, T. Nakajima, Y. Honda, O. Kitao, H. Nakai, T. Vreven, J. A. Montgomery Jr., J. E. Peralta, F. Ogliaro, M. Bearpark, J. J. Heyd, E. Brothers, K. N. Kudin, V. N. Staroverov, R. Kobayashi, J. Nor- mand, K. Raghavachari, A. Rendell, J. C. Burant, S. S. Iyengar, J. Tomasi, M. Cossi, N. Rega, J. M. Millam, M. Klene, J. E. Knox, J. B. Cross, V. Bakken, C. Adamo, J. Jaramillo, R. Gomperts, R. E. Stratmann, O. Yazyev, A. J. Austin, R. Cammi, C. Pomelli, J. W. Ochterski, R. L. Martin, K. Morokuma, V. G. Zakrzewski, G. A. Voth, P. Salvador, J. J. Dannenberg, S. Dapprich, A. D. Daniels, A. Farkas, J. B. Foresman, J. V. Ortiz, J. Cioslowski and D. J. Fox, “Gaussian 09, Revision A.1,” Gaussian, Inc., Wallingford, 2009.
has been cited by the following article:
-
TITLE:
Non Local Corrections to the Electronic Structure of Non Ideal Electron Gases: The Case of Graphene and Tyrosine
AUTHORS:
Yamila García, John Cuffe, Francesc Alzina, Clivia M. Sotomayor-Torres
KEYWORDS:
Nonlocality; Interfaces; Exchange-Correlation Potential; Graphene
JOURNAL NAME:
Journal of Modern Physics,
Vol.4 No.4,
April
29,
2013
ABSTRACT:
We introduce a formal definition of a non local functional and show that the non local exchange-correlation potential functional, derived within Density-Functional Theory, is non local in the space of electronic densities. A previously developed non local exchange-correlation potential term, is introduced to approach the exact density-functional potential. With this approach, the electronic structure of the graphene surface and the tyrosine amino acid are calculated.
Related Articles:
-
Masanori Ono, SaangJoon Baak
-
Sydney N. Jackson, Rongson Pongdee
-
Moawwad E. A. El-Mikkawy
-
Samuel Rhodes, Xiaochen Wang, Wenlang Liang, Hyoung Jin Cho, Jiyu Fang
-
Andreas P. Christodoulides, Theocharis Karaolides, Ziad Milad Ibrahim