Add BrightSurf on Google Email

CSD-Materials suite provides a cohesive analysis of solid form properties for early-phase drug discovery

The CSD-Materials suite provides a comprehensive analysis of solid form properties, helping researchers explore intra- and intermolecular interactions. The suite's components, including Hydrogen Bond Propensity, Full Interaction Maps, and Aromatics Analyser, aid in identifying potential co-former or solvent interactions for new APIs.

SourceCCDC - Cambridge Crystallographic Data Centre·JournalCrystal Growth & Design·DateMar 15, 2022

New research from Pusan National University sheds light on nature of friction in multi-layered graphene

A study by researchers at Pusan National University has investigated the relationship between surface structures and nanoscale friction in multi-layered CVD graphene. They found that only the top-most layer of graphene was twisted with respect to the rest, affecting layer-dependent nanoscale friction.

SourcePusan National University·JournalApplied Surface Science·TypeExperimental study·DateMar 9, 2022

Novel enzyme catalyzing the formation of glycosidic bonds in complex sugar moieties characterized

Researchers have identified a novel enzyme that catalyzes the formation of glycosidic bonds in complex sugar moieties. The discovery provides fresh insights into carbohydrate metabolism and offers a breakthrough for the synthesis of sugar chains, which play key roles in various biological processes.

SourceTokyo University of Science·JournalJournal of Biological Chemistry·TypeExperimental study·DateMar 7, 2022

Surprising semiconductor properties revealed with innovative new method

A new method using a thin oxide film has revealed that oxygen impurities in germanium are responsible for a surprising effect, creating holes in the material and eclipsing its semiconducting properties. This discovery has broad implications for understanding the role of thin oxide films in future semiconductor design.

SourceDOE/Pacific Northwest National Laboratory·JournalPhysical Review Materials·TypeExperimental study·DateMar 1, 2022

Paving the way for a new type of material the properties of which can be controlled and modified at will

Researchers at Politecnico di Milano have discovered a new type of phase transition in a quasi-crystal made of laser light, allowing for the simultaneous control and modification of its properties. This breakthrough could lead to the development of novel materials with unprecedented flexibility and controllability.

SourcePolitecnico di Milano·JournalNature·TypeExperimental study·DateMar 1, 2022

Metal mix and match: An unexpected discovery could improve the crystallinity of coordination nanosheets

Researchers at Tokyo University of Science have discovered a method to improve the crystallinity of coordination nanosheets by mixing two metal ion solutions. This approach results in higher crystallinity and improved performance in devices such as electronics and batteries. The findings open a new pathway for tuning the functional pro...

SourceTokyo University of Science·JournalAdvanced Materials·TypeExperimental study·DateFeb 21, 2022

A star in the world of ceramic engineering

Scientists created new material design principles by studying the complex structure of starfish skeletons. The unique lattice architecture offers mechanical protection, enabling high strength and flexibility while maintaining buoyancy regulation.

SourceVirginia Tech·JournalScience·DateFeb 10, 2022

Crystallography for the misfit crystals

Scientists have developed a new technique called small-molecule serial femtosecond X-ray crystallography (smSFX) that can reveal the structures of not-so-neat-and-tidy materials. This method uses an exceptional X-ray laser and custom-built image processing algorithms to diffract individual granules of powders, providing a precise sharp...

SourceDOE/Lawrence Berkeley National Laboratory·JournalNature·TypeExperimental study·DateJan 19, 2022

New study shows novel crystal structure for hydrogen under high pressure

Researchers from Japan Advanced Institute of Science and Technology have identified a new crystal structure for hydrogen at low temperatures near 0 K and high pressures. The team used supercomputer simulations and data science to generate several candidate patterns, which were then validated through high-resolution simulations.

Towards high-performance organic optoelectronics with better crystallinity at semiconductor interface

Researchers from Tokyo University of Science developed a high-quality crystalline interface using quasi-homo-epitaxial growth, which eliminated mobility issues and enabled spontaneous electron transfer. This breakthrough could lead to highly efficient flexible solar cells and wearable electronic devices.

SourceTokyo University of Science·JournalThe Journal of Physical Chemistry Letters·TypeExperimental study·DateJan 13, 2022

SMART researchers discover novel way to perform ‘general inverse design’ with high accuracy

Researchers from Singapore-MIT Alliance for Research and Technology (SMART) have discovered a way to perform 'general inverse design' with high accuracy. This breakthrough enables the creation of materials with specific characteristics and properties, paving the way for revolutionizing materials science and industrial applications.

SourceSingapore-MIT Alliance for Research and Technology (SMART)·JournalMatter·TypeExperimental study·DateJan 6, 2022

Dual-ligand strategy to regulate metal-organic framework nanocrystals for stable electrochemical cycling performance

Researchers have designed and synthesized stable size/morphology-controlled MOF nanocrystals using a synergetic dual-ligand and hard-soft-acid-base strategy. The resulting 3D pillared-layer structure exhibits excellent cycling performance, with the Ni-Tdc network providing good stability during charging and discharging processes.

SourceScience China Press·JournalNational Science Review·DateJan 5, 2022

How to transform vacancies into quantum information

Scientists have made a breakthrough in controlling the formation of vacancies in silicon carbide, a semiconductor material. The team's simulations tracked the pairing of individual vacancies into a divacancy and discovered the optimal temperatures for creating stable divacancies. This discovery could lead to highly sensitive sensors an...

SourceDOE/Argonne National Laboratory·JournalNature Communications·DateDec 15, 2021

Novel chemical design makes hard crystals stretchy

Researchers have designed porous, carbon-based crystals that can stretch to more than twice their length, making them suitable for nanofiltration and pollutant removal. By adding 'soft joints' into the crystal's scaffold, they can be disrupted by specific chemicals, causing the crystal to expand and contract rapidly.

SourceDartmouth College·JournalChem·DateDec 7, 2021

Machine learning solves the who’s who problem in NMR spectra of organic crystals

Researchers developed a machine learning method to assign NMR spectra of organic crystals probabilistically from their 2D chemical structures. The approach uses a database of chemical shifts for organic solids, reducing computational cost by up to 10,000 times compared to current methods.

SourceNational Centre of Competence in Research (NCCR) MARVEL·JournalScience Advances·TypeComputational simulation/modeling·DateNov 26, 2021

Weak bonds a strength in making borophene

Borophene, a 2D version of boron, can be synthesized on hexagonal boron nitride using weak van der Waals forces. This method allows for easier removal and evaluation of the material for its plasmonic and photonic properties, as well as its electronic properties relevant to superconductivity.

SourceRice University·JournalACS Nano·TypeComputational simulation/modeling·DateNov 12, 2021

A sustainable revolution for drugs, agriculture and food industry of the future: Cryform project starts at the Politecnico di Torino

The CryForm project aims to replace synthetic stabilizing agents with crystalline materials, enabling innovative multiphase formulations for safer, more sustainable and affordable products. The project will develop biocompatible crystals for pharmaceutical, cosmetic and food applications, contributing to the European Green Deal.

SMART researchers discover new way to generate light through use of pre-existing defects in semiconductor materials

SMART researchers have discovered a practical method to overcome current challenges in the manufacture of indium gallium nitride (InGaN) LEDs with considerably higher indium concentration. The new approach uses intrinsic defects in semiconducting materials to form quantum dots that emit long-wavelength light.

SourceSingapore-MIT Alliance for Research and Technology (SMART)·JournalACS Photonics·TypeExperimental study·DateOct 26, 2021

Nanotwinned titanium forges path to sustainable manufacturing

Researchers at Lawrence Berkeley National Laboratory have discovered a new path forward for processing titanium. Cryo-forging at ultra-low temperatures produces extra-strong nanotwinned titanium with improved strength and ductility. The material maintains its structure and properties at extreme temperatures, demonstrating its versatility.

SourceDOE/Lawrence Berkeley National Laboratory·JournalScience·TypeExperimental study·DateOct 20, 2021

Nanoscale lattices flow from 3D printer

Rice materials scientists develop a method to print arbitrary 3D shapes, creating micro-scale electronic, mechanical and photonic devices. The process involves two-photon polymerization and doping with rare earth salts for photoluminescent properties.

SourceRice University·JournalNature Materials·TypeExperimental study·DateOct 14, 2021

Crafting a “sponge” for adsorbing and desorbing gas molecules

A team of scientists has created a novel material composed of catenane molecules, which can adsorb and desorb gas molecules like carbon dioxide. The soft crystal exhibits unique properties, including porosity and deformability, making it suitable for applications such as capturing CO2 molecules.

SourceRIKEN·JournalNature·TypeExperimental study·DateOct 13, 2021

Is your ML training set biased? How to develop new drugs based on merged datasets

Researchers at GlaxoSmithKline and CCDC combined proprietary and published datasets to train machine learning models for predicting stable polymorphs in new drug candidates. The approach leverages the large volume and variety of data in the Cambridge Structural Database, resulting in more confident predictions and improved model accuracy.

Study explores remarkable negative thermal expansion seen in layered ruthenates

A recent study reveals the physical properties responsible for Ca2RuO4's negative thermal expansion (NTE), a phenomenon where materials shrink when heated. The research proposes a new route to designing unconventional NTE materials, which could lead to the creation of composites showing no overall thermal expansion.

SourceTokyo Institute of Technology·JournalChemistry of Materials·TypeCommentary/editorial·DateSep 28, 2021

Finding new alloys just became simpler

Researchers developed a theoretical model to predict the strength of millions of alloys at high temperatures. Experiments confirmed the predictions, highlighting the importance of edge dislocations in determining yield strength in complex high-entropy alloys.

SourceUniversity of Groningen·JournalNature Communications·TypeComputational simulation/modeling·DateSep 16, 2021

Groundbreaking technique yields important new details on silicon, subatomic particles and possible ‘fifth force’

NIST scientists use a novel technique to measure the properties of silicon crystals, revealing new insights into subatomic particles and the strength of a possible fifth force. The results provide improved precision and complementary information for both X-ray and neutron scattering.

SourceNational Institute of Standards and Technology (NIST)·JournalScience·TypeExperimental study·DateSep 9, 2021