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Pablo Ramos
Pablo Ramos
Queens College of the City University of New York
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Cited by
Cited by
Year
Performance of frozen density embedding for modeling hole transfer reactions
P Ramos, M Papadakis, M Pavanello
The Journal of Physical Chemistry B 119 (24), 7541-7557, 2015
352015
Low-lying excited states by constrained DFT
P Ramos, M Pavanello
The Journal of Chemical Physics 148 (14), 144103, 2018
342018
Quantifying environmental effects on the decay of hole transfer couplings in biosystems
P Ramos, M Pavanello
Journal of chemical theory and computation 10 (6), 2546-2556, 2014
222014
Constrained subsystem density functional theory
P Ramos, M Pavanello
Physical Chemistry Chemical Physics 18 (31), 21172-21178, 2016
212016
Charged‐cell periodic DFT simulations via an impurity model based on density embedding: Application to the ionization potential of liquid water
J Tölle, A Severo Pereira Gomes, P Ramos, M Pavanello
International Journal of Quantum Chemistry, e25801, 2018
132018
Ab-Initio Structure and Dynamics of CO2 at Supercritical Conditions
MP Wenhui Mi, Pablo Ramos, Jack Maranhao
The journal of physical chemistry letters, 2019
62019
Capturing multireference excited states by constrained-density-functional theory
N Karpinski, P Ramos, M Pavanello
PHYSICAL REVIEW A 101 (3), 032510, 2020
52020
Probing charge transfer dynamics in a single iron tetraphenylporphyrin dyad adsorbed on an insulating surface
P Ramos, M Mankarious, M Pavanello, D Riedel
Nanoscale 10 (37), 17603-17616, 2018
52018
Nonadiabatic couplings from a variational excited state method based on constrained DFT
P Ramos, M Pavanello
The Journal of Chemical Physics 154 (1), 014110, 2021
42021
Efficient Free Triplet Generation Follows Singlet Fission in Diketopyrrolopyrrole Polymorphs with Goldilocks Coupling
AM Levine, G He, G Bu, P Ramos, F Wu, A Soliman, J Serrano, D Pietraru, ...
J. Phys. Chem. C 125 (22), 12207–1221, 2021
42021
Static Correlation Density Functional Theory
P Ramos, M Pavanello
arXiv preprint arXiv:1906.06661, 2019
42019
A Critical Look at Methods for Calculating Charge Transfer Couplings Fast and Accurately
P Ramos, M Mankarious, M Pavanello
Practical Aspects of Computational Chemistry IV, 103-134, 2016
42016
Structural transformation of Li-excess cathode materials via facile preparation and assembly of sonication-induced colloidal nanocrystals for enhanced lithium storage performance
J Zhao, R Huang, P Ramos, Y Yue, Q Wu, M Pavanello, J Zhou, X Kuai, ...
ACS applied materials & interfaces 9 (36), 31181-31191, 2017
22017
Erratum:“Low-lying excited states by constrained DFT”[J. Chem. Phys. 148, 144103 (2018)]
P Ramos, M Pavanello
The Journal of Chemical Physics 152 (10), 109902, 2020
12020
Role of Dielectric Screening in Calculating Excited States of Solvated Azobenzene: A Benchmark Study Comparing Quantum Embedding and Polarizable Continuum Model for …
C Chakravarty, H Aksu, JA Martinez B, P Ramos, M Pavanello, ...
The Journal of Physical Chemistry Letters 13, 4849-4855, 2022
2022
Theoretical and Experimental Exploration of Organic Synthesis Routes to Obtain Natural Rubber Analogues.
D Gonzalez, D Ramirez, P Ramos, L Garcia
Journal of Materials Science and Engineering A 4 (9), 290-296, 2014
2014
Distance dependent charge transfer couplings and excitation energies in solvated DNA and DNA-indol complexes
P Ramos, M Pavanello
ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 245, 2013
2013
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Articles 1–17