Modeling polymorphic molecular crystals with electronic structure theory
GJO Beran - Chemical reviews, 2016 - ACS Publications
Interest in molecular crystals has grown thanks to their relevance to pharmaceuticals,
organic semiconductor materials, foods, and many other applications. Electronic structure …
organic semiconductor materials, foods, and many other applications. Electronic structure …
Disappearing polymorphs revisited
DK Bučar, RW Lancaster… - Angewandte Chemie …, 2015 - Wiley Online Library
Nearly twenty years ago, Dunitz and Bernstein described a selection of intriguing cases of
polymorphs that disappear. The inability to obtain a crystal form that has previously been …
polymorphs that disappear. The inability to obtain a crystal form that has previously been …
Nanoindentation in crystal engineering: quantifying mechanical properties of molecular crystals
Nanoindentation is a technique for measuring the elastic modulus and hardness of small
amounts of materials. This method, which has been used extensively for characterizing …
amounts of materials. This method, which has been used extensively for characterizing …
Polymorphism− a perspective
J Bernstein - Crystal Growth & Design, 2011 - ACS Publications
Polymorphism − A Perspective | Crystal Growth & Design ACS ACS Publications C&EN CAS
Find my institution Log In Crystal Growth & Design ACS Publications. Most Trusted. Most Cited …
Find my institution Log In Crystal Growth & Design ACS Publications. Most Trusted. Most Cited …
Pharmaceutical cocrystals, salts and polymorphs: Advanced characterization techniques
E Pindelska, A Sokal, W Kolodziejski - Advanced drug delivery reviews, 2017 - Elsevier
The main goal of a novel drug development is to obtain it with optimal physiochemical,
pharmaceutical and biological properties. Pharmaceutical companies and scientists modify …
pharmaceutical and biological properties. Pharmaceutical companies and scientists modify …
Polymorphism, what it is and how to identify it: a systematic review
This review on polymorphism is a personal, non-comprehensive view on the field of
polymorphism–a term which is often misused. Indeed, the discussion about polymorphism …
polymorphism–a term which is often misused. Indeed, the discussion about polymorphism …
van der Waals dispersion interactions in molecular materials: beyond pairwise additivity
AM Reilly, A Tkatchenko - Chemical Science, 2015 - pubs.rsc.org
van der Waals (vdW) dispersion interactions are a key ingredient in the structure, stability,
and response properties of many molecular materials and essential for us to be able to …
and response properties of many molecular materials and essential for us to be able to …
Solvation and surface effects on polymorph stabilities at the nanoscale
We explore the effects of particle size and solvent environment on the thermodynamic
stability of two pairs of polymorphs subjected to ball-mill neat grinding (NG) and liquid …
stability of two pairs of polymorphs subjected to ball-mill neat grinding (NG) and liquid …
Role of dispersion interactions in the polymorphism and entropic stabilization of the aspirin crystal
AM Reilly, A Tkatchenko - Physical review letters, 2014 - APS
Aspirin has been used and studied for over a century but has only recently been shown to
have an additional polymorphic form, known as form II. Since the two observed solid forms of …
have an additional polymorphic form, known as form II. Since the two observed solid forms of …
[BUKU][B] Diffuse X-ray scattering and models of disorder
TR Welberry - 2022 - books.google.com
Diffuse X-ray scattering is a rich source of local structural information over and above that
obtained by conventional crystal structure determination. The main aim of the book is to …
obtained by conventional crystal structure determination. The main aim of the book is to …