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Marcos, Enrique Sánchez
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1

Combining EXAFS and Computer Simulations to Refine the Stru..:

Pérez-Conesa, Sergio ; Martínez, José M. ; Pappalardo, Rafael R..
Molecules.  25 (2020)  22 - p. 5250 , 2020
Link: https://doi.org/10.3390/..
 
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2

A general study of actinyl hydration by molecular dynamics ..:

Pérez-Conesa, Sergio ; Torrico, Francisco ; Martínez, José M...
The Journal of Chemical Physics.  150 (2019)  10 - p. , 2019
Link: https://doi.org/10.1063/..
 
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3

Hydration Structure of the Elusive Ac(III) Aqua Ion: Interp..:

Pappalardo, Rafael R. ; Caralampio, Daniel Z. ; Martínez, José M..
Inorganic Chemistry.  58 (2019)  4 - p. 2777-2783 , 2019
Link: https://doi.org/10.1021/..
 
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4

The hydration structure of the heavy-alkalines Rb+ and Cs+ ..:

Caralampio, Daniel Z. ; Martínez, José M. ; Pappalardo, Rafael R..
Physical Chemistry Chemical Physics.  19 (2017)  42 - p. 28993-29004 , 2017
Link: https://doi.org/10.1039/..
 
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5

Collecting high-order interactions in an effective pairwise..:

Galbis, Elsa ; Hernández-Cobos, Jorge ; Pappalardo, Rafael R..
The Journal of Chemical Physics.  140 (2014)  21 - p. , 2014
Link: https://doi.org/10.1063/..
 
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6

Theoretical and computational chemistry in Spain:

Sodupe, Mariona ; Marcos, Enrique Sánchez
Theoretical Chemistry Accounts.  128 (2011)  4-6 - p. 389-391 , 2011
Link: https://doi.org/10.1007/..
 
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7

Modeling the interactions of phthalocyanines in water: From..:

Martín, Elisa I. ; Martínez, Jose M. ; Marcos, Enrique Sánchez
The Journal of Chemical Physics.  134 (2011)  2 - p. , 2011
Link: https://doi.org/10.1063/..
 
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8

A theoretical study of the hydrogen bond donor capability a..:

Sánchez-Coronilla, Antonio ; Balón, Manuel ; Marcos, Enrique Sánchez..
Physical Chemistry Chemical Physics.  12 (2010)  20 - p. 5276 , 2010
Link: https://doi.org/10.1039/..
 
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9

Coupling CP-MD Simulations and X-ray Absorption Spectroscop..:

Beret, Elizabeth C. ; Provost, Karine ; Müller, Diane.
The Journal of Physical Chemistry B.  113 (2009)  36 - p. 12343-12352 , 2009
Link: https://doi.org/10.1021/..
 
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10

Po(IV) Hydration:  A Quantum Chemical Study:

Ayala, Regla ; Martinez, Jose Manuel ; Pappalardo, Rafael R...
The Journal of Physical Chemistry B.  112 (2008)  17 - p. 5416-5422 , 2008
Link: https://doi.org/10.1021/..
 
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11

Explaining Asymmetric Solvation of Pt(II) versus Pd(II) in ..:

Beret, Elizabeth C. ; Martínez, José M. ; Pappalardo, Rafael R....
Journal of Chemical Theory and Computation.  4 (2008)  12 - p. 2108-2121 , 2008
Link: https://doi.org/10.1021/..
 
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12

Combined Experimental and Theoretical Approach to the Study..:

Carrera, Flora ; Torrico, Francisco ; Richens, David T....
The Journal of Physical Chemistry B.  111 (2007)  28 - p. 8223-8233 , 2007
Link: https://doi.org/10.1021/..
 
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13

Theoretical chemistry of metal and single ions in solutions:

Marcos, Enrique Sánchez
Theoretical Chemistry Accounts.  115 (2006)  2-3 - p. 75-76 , 2006
Link: https://doi.org/10.1007/..
 
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14

Analysis of Main Factors Determining the Prediction of Stab..:

Ayala, Regla ; Martínez, José M. ; Pappalardo, Rafael R..
Theoretical Chemistry Accounts.  116 (2006)  4-5 - p. 691-699 , 2006
Link: https://doi.org/10.1007/..
 
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15

Hydration Structure and Dynamic Properties of the Square Pl..:

Torrico, Francisco ; Pappalardo, Rafael R. ; Marcos, Enrique Sánchez.
Theoretical Chemistry Accounts.  115 (2005)  2-3 - p. 196-203 , 2005
Link: https://doi.org/10.1007/..
 
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