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Melin, Junia
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1

Using the general-purpose reactivity indicator: challenging..:

Anderson, James S. M. ; Melin, Junia ; Ayers, Paul W.
Journal of Molecular Modeling.  22 (2016)  3 - p. , 2016
Link: https://doi.org/10.1007/..
 
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2

On the intrinsic reactivity index for electrophilicity/nucl..:

Chamorro, Eduardo ; Melin, Junia
Journal of Molecular Modeling.  21 (2015)  3 - p. , 2015
Link: https://doi.org/10.1007/..
 
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3

Efficient evaluation of analytic Fukui functions:

Flores-Moreno, Roberto ; Melin, Junia ; Ortiz, J. V..
The Journal of Chemical Physics.  129 (2008)  22 - p. , 2008
Link: https://doi.org/10.1063/..
 
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4

Removing Electrons Can Increase the Electron Density:  A Co..:

Melin, Junia ; Ayers, Paul W. ; Ortiz, Joseph Vincent
The Journal of Physical Chemistry A.  111 (2007)  40 - p. 10017-10019 , 2007
Link: https://doi.org/10.1021/..
 
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5

Conceptual Density-Functional Theory for General Chemical R..:

Anderson, James S. M. ; Melin, Junia ; Ayers, Paul W.
Journal of Chemical Theory and Computation.  3 (2007)  2 - p. 358-374 , 2007
Link: https://doi.org/10.1021/..
 
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6

Conceptual Density-Functional Theory for General Chemical R..:

Anderson, James S. M. ; Melin, Junia ; Ayers, Paul W.
Journal of Chemical Theory and Computation.  3 (2007)  2 - p. 375-389 , 2007
Link: https://doi.org/10.1021/..
 
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7

Tautomeric Forms of Azolide Anions:  Vertical Electron Deta..:

Melin, Junia ; Singh, Raman K. ; Mishra, Manoj K..
The Journal of Physical Chemistry A.  111 (2007)  50 - p. 13069-13074 , 2007
Link: https://doi.org/10.1021/..
 
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8

OH3− and O2H5− double Rydberg anions: Predictions and compa..:

Melin, Junia ; Ortiz, J. V.
The Journal of Chemical Physics.  127 (2007)  1 - p. , 2007
Link: https://doi.org/10.1063/..
 
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9

Electronic Structure Analysis and Electron Detachment Energ..:

Melin, Junia ; Mishra, Manoj K. ; Ortiz, J. V.
The Journal of Physical Chemistry A.  110 (2006)  44 - p. 12231-12235 , 2006
Link: https://doi.org/10.1021/..
 
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10

Computing the Fukui function from ab initio quantum chemist..:

Ayers, Paul W. ; Melin, Junia
Theoretical Chemistry Accounts.  117 (2006)  3 - p. 371-381 , 2006
Link: https://doi.org/10.1007/..
 
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11

The electron-propagator approach to conceptual density-func..:

Melin, Junia ; Ayers, Paul W. ; Ortiz, J. V.
Journal of Chemical Sciences.  117 (2005)  5 - p. 387-400 , 2005
Link: https://doi.org/10.1007/..
 
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12

Ground and excited states of the Rydberg radical H3O: Elect..:

Melin, Junia ; Ortiz, J. V. ; Martín, I...
The Journal of Chemical Physics.  122 (2005)  23 - p. , 2005
Link: https://doi.org/10.1063/..
 
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13

Is the Fukui Function a Right Descriptor of Hard−Hard Inter..:

Melin, Junia ; Aparicio, Felipe ; Subramanian, Venkatesan..
The Journal of Physical Chemistry A.  108 (2004)  13 - p. 2487-2491 , 2004
Link: https://doi.org/10.1021/..
 
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14

Probing the hydride transfer process in the lumiflavine–1-m..:

Rivas, Pilar ; Zapata-Torres, Gerald ; Melin, Junia.
Tetrahedron.  60 (2004)  19 - p. 4189-4196 , 2004
Link: https://doi.org/10.1016/..
 
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15

Application of the electron localization function to radica..:

Melin, Junia ; Fuentealba, P.
International Journal of Quantum Chemistry.  92 (2003)  4 - p. 381-390 , 2003
Link: https://doi.org/10.1002/..
 
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