Carlos Bernardes
Carlos Bernardes
CQE, Faculty of Sciences, Lisbon University
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Zitiert von
Zitiert von
Structure and aggregation in the 1-alkyl-3-methylimidazolium bis (trifluoromethylsulfonyl) imide ionic liquid homologous series
K Shimizu, CES Bernardes, JN Canongia Lopes
The Journal of Physical Chemistry B 118 (2), 567-576, 2014
The structure of aqueous solutions of a hydrophilic ionic liquid: The full concentration range of 1-ethyl-3-methylimidazolium ethylsulfate and water
CES Bernardes, ME Minas da Piedade, JN Canongia Lopes
The Journal of Physical Chemistry B 115 (9), 2067-2074, 2011
Nano-segregation in ionic liquids: scorpions and vanishing chains
K Shimizu, CES Bernardes, A Triolo, JNC Lopes
Physical Chemistry Chemical Physics 15 (38), 16256-16262, 2013
Inorganic salts in purely ionic liquid media: the development of high ionicity ionic liquids (HIILs)
AB Pereiro, JMM Araújo, FS Oliveira, CES Bernardes, JMSS Esperança, ...
Chemical communications 48 (30), 3656-3658, 2012
Mutual Solubility of Water and Structural/Positional Isomers of N-Alkylpyridinium-Based Ionic Liquids
MG Freire, CMSS Neves, K Shimizu, CES Bernardes, IM Marrucho, ...
The Journal of Physical Chemistry B 114 (48), 15925-15934, 2010
Structure and aggregation in the 1, 3-dialkyl-imidazolium bis (trifluoromethylsulfonyl) imide ionic liquid family: 2. From single to double long alkyl side chains
CES Bernardes, K Shimizu, AIMC Lobo Ferreira, LM Santos, ...
The Journal of Physical Chemistry B 118 (24), 6885-6895, 2014
Evaluation of the OPLS-AA force field for the study of structural and energetic aspects of molecular organic crystals
CES Bernardes, A Joseph
The Journal of Physical Chemistry A 119 (12), 3023-3034, 2015
Comparative study of Al-MCM materials prepared at room temperature with different aluminium sources and by some hydrothermal methods
MMLR Carrott, FL Conceição, JM Lopes, PJM Carrott, C Bernardes, ...
Microporous and mesoporous materials 92 (1-3), 270-285, 2006
Ionic liquids with anions based on fluorosulfonyl derivatives: from asymmetrical substitutions to a consistent force field model
ASL Gouveia, CES Bernardes, LC Tomé, EI Lozinskaya, YS Vygodskii, ...
Physical Chemistry Chemical Physics 19 (43), 29617-29624, 2017
Polymorphism in 4′-hydroxyacetophenone: Structure and Energetics
CES Bernardes, MFM Piedade, MEM Piedade
Crystal Growth and Design 8 (7), 2419-2430, 2008
A new calorimetric system to measure heat capacities of solids by the drop method
CES Bernardes, LM Santos, MEM da Piedade
Measurement Science and Technology 17 (6), 1405, 2006
Energetics and structure of nicotinic acid (niacin)
EM Gonçalves, CES Bernardes, HP Diogo, ME Minas da Piedade
The Journal of Physical Chemistry B 114 (16), 5475-5485, 2010
AGGREGATES: Finding structures in simulation results of solutions
CES Bernardes
Journal of computational chemistry 38 (10), 753-765, 2017
Additive polarizabilities in ionic liquids
CES Bernardes, K Shimizu, JNC Lopes, P Marquetand, E Heid, ...
Physical Chemistry Chemical Physics 18 (3), 1665-1670, 2016
Polymorphic Phase Transition in 4′-Hydroxyacetophenone: Equilibrium Temperature, Kinetic Barrier, and the Relative Stability of Z′ = 1 and Z′ = 2 Forms
A Joseph, CES Bernardes, AI Druzhinina, RM Varushchenko, TY Nguyen, ...
Crystal Growth & Design 17 (4), 1918-1932, 2017
All-Atom Force Field for Molecular Dynamics Simulations on Organotransition Metal Solids and Liquids. Application to M(CO)n (M = Cr, Fe, Ni, Mo, Ru, or W …
CES Bernardes, JN Canongia Lopes, MEM da Piedade
The Journal of Physical Chemistry A 117 (43), 11107-11113, 2013
Structure–property relationships in protic ionic liquids: a study of solvent–solvent and solvent–solute interactions
JESJ Reid, CES Bernardes, F Agapito, F Martins, S Shimizu, ...
Physical Chemistry Chemical Physics 19 (41), 28133-28138, 2017
Heat capacity and thermodynamics of solid and liquid pyridine-3-carboxylic acid (nicotinic acid) over the temperature range 296 K to 531 K
A Joseph, CES Bernardes, MEM da Piedade
The Journal of Chemical Thermodynamics 55, 23-28, 2012
Energetics of the O− H Bond and of Intramolecular Hydrogen Bonding in HOC6H4C (O) Y (Y= H, CH3, CH2CH CH2, C CH, CH2F, NH2, NHCH3, NO2, OH, OCH3, OCN, CN, F, Cl, SH, and SCH3 …
CES Bernardes, ME Minas da Piedade
The Journal of Physical Chemistry A 112 (40), 10029-10039, 2008
Energetics of cresols and of methylphenoxyl radicals
LS Richard, CES Bernardes, HP Diogo, JP Leal, ME Minas da Piedade
The Journal of Physical Chemistry A 111 (35), 8741-8748, 2007
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