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Showing results 15 to 27 of 27
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Issue Date
Title
Author(s)
Type
Access Type
24-Nov-2021
New force-field for organosilicon molecules in the liquid phase
Jorge, Miguel
;
Milne, Andrew W.
;
Barrera, Maria Cecilia
;
Gomes, José R. B.
article
1-Aug-2023
Polarization-consistent force field for ketones
Barrera, Maria Cecilia
;
Cree, Jordan
;
Gomes, José R.B.
;
Jorge, Miguel
article
1-May-2019
Rationalizing the phase behavior of triblock copolymers through experiments and molecular simulations
Pérez-Sánchez, Germán
;
Vicente, Filipa A.
;
Schaeffer, Nicolas
;
Cardoso, Inês S.
;
Ventura, Sónia P. M.
;
Jorge, Miguel
;
Coutinho, João A. P.
article
2013
Role of the organic linker in the early stages of the templated synthesis of PMOs
Futamura, Ryusuke
;
Jorge, Miguel
;
Gomes, Jose R. B.
article
2013
Salting-in with a Salting-out Agent: Explaining the Cation Specific Effects on the Aqueous Solubility of Amino Acids
Tome, Luciana I. N.
;
Pinho, Simao P.
;
Jorge, Miguel
;
Gomes, Jose R. B.
;
Coutinho, Joao A. P.
article
15-Jan-2021
Self-consistent electrostatic embedding for liquid phase polarization
Jorge, Miguel
;
Gomes, José R.B.
;
Milne, Andrew W.
article
25-Mar-2022
Sticky-MARTINI as a reactive coarse-grained model for molecular dynamics simulations of silica polymerization
Carvalho, André P.
;
Santos, Sérgio M.
;
Pérez-Sánchez, Germán
;
Gouveia, Daniel
;
Gomes, José R. B.
;
Jorge, Miguel
article
2013
Structures and energetics of organosilanes in the gaseous phase: a computational study
Futamura, Ryusuke
;
Jorge, Miguel
;
Gomes, Jose R. B.
article
15-Jun-2022
The dipole moment of alcohols in the liquid phase and in solution
Jorge, Miguel
;
Gomes, José R. B.
;
Barrera, Maria Cecilia
article
2015
Understanding Gas Adsorption Selectivity in IRMOF-8 Using Molecular Simulation
Pillai, Renjith S
;
Pinto, Moises L
;
Pires, Joao
;
Jorge, Miguel
;
Gomes, Jose R B
article
2015
Understanding Gas Adsorption Selectivity in IRMOF-8 Using Molecular Simulation
Pillai, Renjith S.
;
Pinto, Moises L.
;
Pires, Joao
;
Jorge, Miguel
;
Gomes, Jose R. B.
article
13-Aug-2020
Unravelling the interactions between surface-active ionic liquids and triblock copolymers for the design of thermal responsive systems
Pérez-Sánchez, Germán
;
Vicente, Filipa A.
;
Schaeffer, Nicolas
;
Cardoso, Inês S.
;
Ventura, Sónia P. M.
;
Jorge, Miguel
;
Coutinho, João A. P.
article
2013
Water adsorption on a copper formate paddlewheel model of CuBTC: A comparative MP2 and DFT study
Toda, Jordi
;
Fischer, Michael
;
Jorge, Miguel
;
Gomes, Jose R. B.
article