Miguel Fuentes-Cabrera
Miguel Fuentes-Cabrera
Center for Nanophase Materials Science, Oak Ridge National Laboratory
Adresse e-mail validée de ornl.gov
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Bridge structure for the graphene/Ni (111) system: a first principles study
M Fuentes-Cabrera, MI Baskes, AV Melechko, ML Simpson
Physical Review B 77 (3), 035405, 2008
1912008
Electronic structure and properties of isoreticular metal-organic frameworks: The case of -IRMOF1 (, Cd, Be, Mg, and Ca)
M Fuentes-Cabrera, DM Nicholson, BG Sumpter, M Widom
The Journal of chemical physics 123 (12), 124713, 2005
1562005
Dynamic defrosting on nanostructured superhydrophobic surfaces
JB Boreyko, BR Srijanto, TD Nguyen, C Vega, M Fuentes-Cabrera, ...
Langmuir 29 (30), 9516-9524, 2013
1472013
Characterization of the tunneling conductance across DNA bases
R Zikic, PS Krstić, XG Zhang, M Fuentes-Cabrera, J Wells, X Zhao
Physical Review E 74 (1), 011919, 2006
772006
First-principles transversal DNA conductance deconstructed
XG Zhang, PS Krstić, R Zikić, JC Wells, M Fuentes-Cabrera
Biophysical journal 91 (1), L04-L06, 2006
762006
Atomic‐Level Sculpting of Crystalline Oxides: Toward Bulk Nanofabrication with Single Atomic Plane Precision
S Jesse, Q He, AR Lupini, DN Leonard, MP Oxley, O Ovchinnikov, ...
Small 11 (44), 5895-5900, 2015
662015
The application of approximate density functionals to complex systems
OF Sankey, AA Demkov, W Windl, JH Fritsch, JP Lewis, ...
International journal of quantum chemistry 69 (3), 327-340, 1998
641998
Molecular dynamics study of the dewetting of copper on graphite and graphene: Implications for nanoscale self-assembly
M Fuentes-Cabrera, BH Rhodes, JD Fowlkes, A López-Benzanilla, ...
Physical Review E 83 (4), 041603, 2011
592011
Size-expanded DNA bases: An ab initio study of their structural and electronic properties
M Fuentes-Cabrera, BG Sumpter, JC Wells
The Journal of Physical Chemistry B 109 (44), 21135-21139, 2005
592005
Local aromaticity in natural nucleobases and their size-expanded benzo-fused derivatives
O Huertas, J Poater, M Fuentes-Cabrera, M Orozco, M Sola, FJ Luque
The Journal of Physical Chemistry A 110 (44), 12249-12258, 2006
532006
Theoretical study on the structure, stability, and electronic properties of the guanine− Zn− cytosine base pair in M-DNA
M Fuentes-Cabrera, BG Sumpter, JE Šponer, J Šponer, L Petit, JC Wells
The Journal of Physical Chemistry B 111 (4), 870-879, 2007
522007
Supramolecular Self-Assembly of π-Conjugated Hydrocarbons via 2D Cooperative CH/π Interaction
Q Li, C Han, SR Horton, M Fuentes-Cabrera, BG Sumpter, W Lu, ...
ACS nano 6 (1), 566-572, 2012
482012
Size-expanded yDNA bases: An ab initio study
M Fuentes-Cabrera, BG Sumpter, P Lipkowski, JC Wells
The Journal of Physical Chemistry B 110 (12), 6379-6384, 2006
452006
Molecular dynamics simulations of the decamer in crystal environment: Comparison of atomic point-charge, extra-point, and polarizable force fields
J Baucom, T Transue, M Fuentes-Cabrera, JM Krahn, TA Darden, C Sagui
The Journal of chemical physics 121 (14), 6998-7008, 2004
452004
Formamide-based prebiotic synthesis of nucleobases: a kinetically accessible reaction route
JE Šponer, A Mládek, J Šponer, M Fuentes-Cabrera
The Journal of Physical Chemistry A 116 (1), 720-726, 2012
402012
Evaluation of functionalized isoreticular metal organic frameworks (IRMOFs) as smart nanoporous preconcentrators of RDX
R Xiong, K Odbadrakh, A Michalkova, JP Luna, T Petrova, DJ Keffer, ...
Sensors and Actuators B: Chemical 148 (2), 459-468, 2010
372010
Theoretical study on the factors controlling the stability of the borate complexes of ribose, arabinose, lyxose, and xylose
JE Šponer, BG Sumpter, J Leszczynski, J Šponer, M Fuentes‐Cabrera
Chemistry–A European Journal 14 (32), 9990-9998, 2008
362008
Prebiotic routes to nucleosides: a quantum chemical insight into the energetics of the multistep reaction pathways
JE Šponer, J Šponer, M Fuentes‐Cabrera
Chemistry–A European Journal 17 (3), 847-854, 2011
342011
Direct atomic fabrication and dopant positioning in Si using electron beams with active real-time image-based feedback
S Jesse, BM Hudak, E Zarkadoula, J Song, A Maksov, M Fuentes-Cabrera, ...
Nanotechnology 29 (25), 255303, 2018
312018
Engineering the bacterial microcompartment domain for molecular scaffolding applications
EJ Young, R Burton, JP Mahalik, BG Sumpter, M Fuentes-Cabrera, ...
Frontiers in microbiology 8, 1441, 2017
312017
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