| 1 |
Effect of nanoparticles in molten salts - MD simulations and experimental study
Svobodova-Sedlackova A, Barreneche C, Alonso G, Fernandez AI, Gamallo P
Renewable Energy, 152, 208, 2020 |
| 2 |
Energetic evaluation of swing adsorption processes for CO2 capture in selected MOFs and zeolites: Effect of impurities
Bahamon D, Diaz-Marquez A, Gamallo P, Vega LF
Chemical Engineering Journal, 342, 458, 2018 |
| 3 |
Comparing the catalytic activity of the water gas shift reaction on Cu(321) and Cu(111) surfaces: Step sites do not always enhance the overall reactivity
Prats H, Gamallo P, Illas F, Sayos R
Journal of Catalysis, 342, 75, 2016 |
| 4 |
Born-Oppenheimer and Renner-Teller Quantum Dynamics of CH(X-2 Pi) + D(S-2) Reactions on Three CHD Potential Surfaces
Gamallo P, Akpinar S, Defazio P, Petrongolo C
Journal of Physical Chemistry A, 119(46), 11254, 2015 |
| 5 |
Quantum Dynamics of the Reaction H(S-2) + HeH+(X-1 Sigma(+)) -> H-2(+)(X-2 Sigma(+)(g)) + He(S-1) from Cold to Hyperthermal Energies: Time-Dependent Wavepacket Study and Comparison with Time-Independent Calculations
Gamallo P, Akpinar S, Defazio P, Petrongolo C
Journal of Physical Chemistry A, 118(33), 6451, 2014 |
| 6 |
Resonances in the Ne + H-2(+) -> NeH+ + H Proton-Transfer Reaction
Gamallo P, Huarte-Larranaga F, Gonzalez M
Journal of Physical Chemistry A, 117(26), 5393, 2013 |
| 7 |
Adiabatic Quantum Dynamics of CH(X-2 Pi)+H(S-2) Reactions on the CH2((X)over-tilde(3)A'') Surface and Role of the Excited Electronic States
Gamallo P, Defazio P, Akpinar S, Petrongolo C
Journal of Physical Chemistry A, 116(32), 8291, 2012 |
| 8 |
Theoretical Study of the Dynamics and Kinetics of the O plus CS -> CO plus S Chemical Laser Reaction, Where CO Shows a Very High Vibrational Excitation
Gamallo P, Francia R, Martinez R, Sayos R, Gonzalez M
Journal of Physical Chemistry A, 116(48), 11783, 2012 |
| 9 |
Time Dependent Quantum Dynamics Study of the Ne + H-2(+)(v(0)=0-4, j(0)=1) -> NeH+ + H Proton Transfer Reaction, Including the Coriolis Coupling. A System with Oscillatory Cross Sections
Gamallo P, Defazio P, Gonzalez M
Journal of Physical Chemistry A, 115(42), 11525, 2011 |
| 10 |
Renner-Teller Quantum Dynamics of NH(a(1)Delta) + H Reactions on the NH2 (A)over-cap(2)A(1) and (X)over-tilde(2)B(1) Coupled Surfaces
Defazio P, Gamallo P, Gonzalez M, Petrongolo C
Journal of Physical Chemistry A, 114(36), 9749, 2010 |
