Molecular Energetics Group

 

Crystal Engineering through Solvent Mediated Control of Molecular Conformation: The Case of 5-Hydroxynicotinic Acid

M. F. M. Piedade, A. Joseph, J. Rodrigues Alves, C. E. S. Bernardes, F. Emmerling, M. E. Minas da Piedade

49^th Annual Conference of the British Association for Crystal Growth, Limerick, Ireland, 19-22 June 2018; P84. Abstract

 

Packing Energetics in 4-HOC₆H₄COR Compounds: The Influence of the Side Chain

R. G. Simões, C. S. D. Lopes, C. E. S. Bernardes, M. F. M. Piedade, M. E. Minas da Piedade

49^th Annual Conference of the British Association for Crystal Growth, Limerick, Ireland, 19-22 June 2018; P14. Abstract

 

Synthesis and Energetics of Maleic acid-Glycine and Fumaric acid-Glycine Binary Crystals

A. O. L. Évora, M. F. M. Piedade, M. E. S. Eusébio, T. Leyssens, M. E. Minas da Piedade

49^th Annual Conference of the British Association for Crystal Growth, Limerick, Ireland, 19-22 June 2018; P26. Abstract

 

Real-time In-situ Synchrotron Study of Simvastatin Crystallization on Levitated Droplets

M. Heilmann, C. E. S. Bernardes, F. Emmerling, M. E. Minas da Piedade

49^th Annual Conference of the British Association for Crystal Growth, Limerick, Ireland, 19-22 June 2018; Invited Oral Communication. Abstract

 

Crystal Structure Determination and Molecular Mobility Study in the Glass Phase of a Cholesteric Liquid Crystal: Cholesteryl Hydrogen Phthalate (CHP)

H.P. Diogo, M. F. M. Piedade

49^th Annual Conference of the British Association for Crystal Growth, Limerick, Ireland, 19-22 June 2018; P75. Abstract

 

Polymorphism in a Liquid Crystal: 4-Cyanophenyl 4-buthylbenzoate

H.P. Diogo, M. F. M. Piedade

49^th Annual Conference of the British Association for Crystal Growth, Limerick, Ireland, 19-22 June 2018; P50. Abstract

 

From Molecules to Crystals: An Experimental and Theoretical Overview

C. E. S. Bernardes

49^th Annual Conference of the British Association for Crystal Growth, Limerick, Ireland, 19-22 June 2018; P10. Abstract

 

Polymorphism in 4’-Hydroxyacetophenone: The full Picture from 0 K to Fusion

C. E. S. Bernardes P. L. T. Melo, D. Y. Ilin, V. A. Lukyanova, A. I. Druzhinina, M. E. Minas da Piedade

2019 Annual Conference of the British Association of Crystal Growth (BACG), Royal Society, London, UK; P09, p. 62. Abstract

 

Screening Polymorphism in 4-HOC6H4COR Compounds

M. F. M. Piedade, R. G. Simões; C. S. D. Lopes, C. E. S. Bernardes; M. E. Minas da Piedade

2019 Annual Conference of the British Association of Crystal Growth (BACG), Royal Society, London, UK; P063, p. 116. Abstract

 

Multicomponent Forms of the Regioisomers Fumaric and Maleic Acids wit Glycine: Salt or Co-crystal?

M. F. M. Piedade, A. O. L. Évora, C. E. S. Bernardes, A. C. L. Conceição, M. E. Minas da Piedade

The 10^th Convention on Crystal Forms@Bologna, Making, discovering, protecting and using crystals, Bologna, Italy, 2019. Abstract

 

A Force Field for Halogenated Active Pharmaceutical Ingredients

C. S. D. Lopes, C. E. S. Bernardes, M. E. Minas da Piedade

International School of Chemistry: Chemistry for Everyday Life Web Edition, Camerino, Italy, September 2020, FP29. Abstract

 

Calorimetry as a Tool to Investigate Polymorphism in Organic Compounds

I. O. Feliciano, C. E. S.Bernardes, M. E. Minas da Piedade

International School of Chemistry: Chemistry for Everyday Life Web Edition, Camerino, Italy, September 2020, P12, p86. Abstract

 

The Standard Molar Enthalpy of the 4'-Hydroxyacetophenone Polymorphic Phase Transition as Benchmark for Solution Calorimetry Measurements

I. O.Feliciano, C. E. S.Bernardes, M. E. Minas da Piedade

The 24^th Kalorimetrietage, web edition, 26-28 May, 2021, p144. Abstract

 

Influence of Stoichiometry on the Energetics of a Two-component Crystal System

I. O. Feliciano, C. E. S. Bernardes, M. E. Minas da Piedade, M. F. M. Piedade, D. Silva

BCA/BACG Spring Meeting, London, UK, March 2021, CCG16. Abstract

 

Crystallization of Sulfonamides: A Phase Diagram, Calorimetric and NMR Spectroscopy Study

C. S. D. Lopes, C. E. S. Bernardes, M. E. Minas da Piedade

BCA/BACG Spring Meeting, London, UK, March 2021, CCG15. Abstract

 

Molecular Structure in a Saturated Solution and in the Solid in Equilibrium with that Solution: The Case of the Hydroxynicotinic Acid Family

C. V. Esteves, C. E. S. Bernardes, M. E. Minas da Piedade

BCA/BACG Spring Meeting, London, UK, March 2021,; CCG09. Abstract

 

Polymorphism in 4'-Hydroxyvalerophenone: A Structure/Energetics/Dynamics Perspective

R. G. Simões, C. S. D. Lopes, M. F. M. Piedade, C. E. S. Bernardes, H. P. Diogo, M. E. Minas da Piedade

BCA/BACG Spring Meeting, London, UK, March 2021, CCG11. Abstract

 

Solubility Measurements: A Powerful Tool to Investigate Polymorphism in Molecular Organic Solids and Molecular Self-Assembly in Solution

M. E. Minas da Piedade

19th International Symposium on Solubility Phenomena and Related Equilibrium Processes (ISSP-19), Virtual, July 11-16, 2021. Abstract

 

Solubility of Simvastatin in Acetone, Ethyl acetate, and Ethanol: An Experimental and MD Simulation Study

R. G. Simões

19th International Symposium on Solubility Phenomena and Related Equilibrium Processes (ISSP-19), Virtual, July 11-16, 2021. Abstract