Physical chemistry – Page 20
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ResearchMolecular state switching technique offers insight into reactions’ complexity
New technique offers exceptional chemical control
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ResearchSimulation says supercritical water has no hydrogen bonds
Computational approach seeks to clarify bonding confusion
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ResearchIBM seeks to simplify robotic chemistry
RoboRXN system extends AI approach to extracting and checking chemistry information from patent literature to programming automation
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ResearchSulfur study delivers first experimental proof of a liquid–liquid critical point
Researchers interpret density anomaly as a sign of the critical opalescence phenomenon
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OpinionChemists amid coronavirus: Anya Gryn’ova
The computational chemist has returned to her Heidelberg research institute after months of lockdown, and is thankful to be living in Germany
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ResearchMass spectrometry and augmented reality guide tumour removal in real time
Colour pixels help surgeons differentiate between cancerous and healthy tissue
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ResearchHydrogen bond imparts more stability on transition state than expected
Study reveals importance of repulsive interactions
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ArticleInnovating in complex environments
The benefits of digital tools and automation with no programming required
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ResearchMagnetic shielding maps reveal molecules’ aromaticity
Computational method is intuitive way to visualise Clar’s rule in polycyclic aromatic hydrocarbons
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ResearchNMR findings suggest solution to enhanced diffusion dispute
Energy release rate may solve the puzzle of why the phenomenon is seen in some systems but not others
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NewsExplainer: What is quantum tunnelling?
Welcome to a weird world where reactions that ought to be impossible occur regularly
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ResearchRubidium atoms’ tunnelling time measured with quantum stopwatch
Ultracold atom’s time inside forbidden barrier determined, but experiment might not resolve the controversy surrounding tunnelling time
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ResearchAI reactivity predictor considers both molecular and electronic properties
Machine-learning model tested on electrochemical systems
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ResearchComplex molecule diffraction can start to Bragg
Diffraction with a drug and a dye takes interferometry with large molecules to the next level
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ResearchMacrocycles slide freely across carbon nanotubes
Simulations suggest macrocycles show superlubricity at room temperature
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ResearchComputational study supports theory that water has a second critical point
Liquid-liquid phase transition at deeply supercooled conditions could explain water’s distinctive behavior
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ResearchAlgorithm predicts mortality of Covid-19 patients from blood biomarkers
Artificial intelligence tool to help doctors prioritise treatment
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ResearchMechanism maps predict chemoselectivity of NHC-catalysed transformations
Product forecasts from energy barrier calculations will help guide organocatalytic reactions
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RSCWelcoming a new era: A time for digital scientific discovery
Robots, artificial intelligence and machine learning are evolving chemistry practice. The Royal Society of Chemistry has a plan for harnessing our increasingly digitalised world