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Erik Santiso
Erik Santiso
Associate Professor of Chemical and Biomolecular Engineering, North Carolina State University
Email confirmado em ncsu.edu - Página inicial
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Dissociation of water on defective carbon substrates
MK Kostov, EE Santiso, AM George, KE Gubbins, MB Nardelli
Physical review letters 95 (13), 136105, 2005
1552005
Dense packing of binary and polydisperse hard spheres
E Santiso, EA Müller
Molecular Physics 100 (15), 2461-2469, 2002
952002
Adsorption and catalysis: The effect of confinement on chemical reactions
EE Santiso, AM George, CH Turner, MK Kostov, KE Gubbins, ...
Applied surface science 252 (3), 766-777, 2005
932005
A general set of order parameters for molecular crystals
EE Santiso, BL Trout
The Journal of chemical physics 134 (6), 064109, 2011
902011
Multi-scale molecular modeling of chemical reactivity
EE Santiso, KE Gubbins
Molecular Simulation 30 (11-12), 699-748, 2004
842004
On the calculation of solid-fluid contact angles from molecular dynamics
EE Santiso, C Herdes, EA Müller
Entropy 15 (9), 3734-3745, 2013
732013
Perovskite-structured AMn x B 1− x O 3 (A= Ca or Ba; B= Fe or Ni) redox catalysts for partial oxidation of methane
A Mishra, N Galinsky, F He, EE Santiso, F Li
Catalysis Science & Technology 6 (12), 4535-4544, 2016
552016
Separation of chemical reaction intermediates by metal–organic frameworks
A Centrone, EE Santiso, TA Hatton
Small 7 (16), 2356-2364, 2011
532011
Molecular modeling of freezing of simple fluids confined within carbon nanotubes
FR Hung, B Coasne, EE Santiso, KE Gubbins, FR Siperstein, ...
The Journal of chemical physics 122 (14), 144706, 2005
522005
Confinement effects on chemical reactions—Toward an integrated rational catalyst design
EE Santiso, MK Kostov, AM George, MB Nardelli, KE Gubbins
Applied surface science 253 (13), 5570-5579, 2007
502007
Modelling the interfacial behaviour of dilute light-switching surfactant solutions
C Herdes, EE Santiso, C James, J Eastoe, EA Müller
Journal of colloid and interface science 445, 16-23, 2015
442015
Carbon sequestration through CO2 foam-enhanced oil recovery: a green chemistry perspective
JA Clark, EE Santiso
Engineering 4 (3), 336-342, 2018
392018
Oxygen vacancy creation energy in Mn-containing perovskites: an effective indicator for chemical looping with oxygen uncoupling
A Mishra, T Li, F Li, EE Santiso
Chemistry of Materials 31 (3), 689-698, 2018
352018
Effect of confinement on chemical reactions
EE Santiso, AM George, M Sliwinska-bartkowiak, MB Nardelli, ...
Adsorption 11 (1), 349-354, 2005
352005
Catalytic role of carbons in methane decomposition for CO- and -free hydrogen generation
L Huang, EE Santiso, MB Nardelli, KE Gubbins
The Journal of chemical physics 128 (21), 214702, 2008
332008
Curvature dependency of surface tension in multicomponent systems
E Santiso, A Firoozabadi
AIChE journal 52 (1), 311-322, 2006
322006
Computer simulations of homogeneous nucleation of benzene from the melt
M Shah, EE Santiso, BL Trout
The Journal of Physical Chemistry B 115 (35), 10400-10412, 2011
312011
Pressure enhancement in confined fluids: effect of molecular shape and fluid–wall interactions
D Srivastava, EE Santiso, KE Gubbins
Langmuir 33 (42), 11231-11245, 2017
282017
Computationally Mapping pKa Shifts Due to the Presence of a Polyelectrolyte Chain around Whey Proteins
D Srivastava, E Santiso, K Gubbins, FL Barroso da Silva
Langmuir 33 (42), 11417-11428, 2017
282017
A remarkable shape-catalytic effect of confinement on the rotational isomerization of small hydrocarbons
EE Santiso, M Buongiorno Nardelli, KE Gubbins
The Journal of chemical physics 128 (3), 034704, 2008
272008
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