Physical chemistry
The latest chemistry news and research on physical chemistry, including quantum and theoretical, bonding, computational and surfaces and interfaces, from the Royal Society of Chemistry's magazine, Chemistry World
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OpinionWe need to build the data that chemistry deserves - here’s how we can do it
Creating a purpose-built repository of standardised reaction data is a tall order, but the reward would be huge
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ResearchGraphene-enhanced supramolecular gels direct how drug molecules crystallise
System could be useful in preformulation stage of drug development
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ResearchMicrowaves’ non-thermal effects on a chemical reaction demonstrated for first time
Molecular beam experiments shift reaction rate by manipulating reactant’s quantum state
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FeatureCrystal clear structure prediction
As the clouds clear on computational crystal structure prediction, is the technique ready to empower mainstream materials research? James Mitchell Crow reports
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NewsChatbot developers hope to make computational chemistry more accessible
AutoSolvateWeb could help undergraduates upwards simulate solvation
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ResearchCollective coupling strength must be larger than previously thought to guarantee delocalised polaritons
Findings challenge previously accepted criteria for robust delocalisation within the strong coupling regime
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ResearchCarbon–boron triple bond formed for the first time in a neutral novel molecule
Synthesis could help chemists better understand bonding
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ResearchClearest ever picture of worms’ surface chemistry deepens evolutionary understanding
Cutting-edge mass spectrometry of nematodes’ ‘skin’ may reveal new ways to control parasitic infections
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OpinionChemists amid coronavirus five years on: Anya Gryn’ova
A computational chemist has moved from being group leader at a German research institute to an associate computational chemistry prof in the UK
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OpinionChemists amid coronavirus five years on: Lee Cronin
A University of Glasgow chemist describes how Covid-19 helped establish the principle of chemputation and spur a chemistry revolution
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OpinionUlam’s Monte Carlo method and the harnessing of randomness
Randomness in the service of confidence
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ResearchSupramolecular ‘qudits’ offer a way to power-up quantum computers
Hydrogen bonding harnessed to produce molecular qubit with four quantum states
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ResearchComputational study says nucleophile finds σ-holes more attractive than π-holes
A σ-hole leads to a stronger bond with NH3 than a π-hole on the same atom
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WhitepaperPass or fail: rapid polymer analysis with FTIR
Your guide to quick and reliable verification of polymers with the Lyza 7000 FTIR spectrometer
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OpinionLetters: February 2025
A reader argues for greater use of quantum chemistry in Iupac definitions
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News‘Chemistry will no longer be an exclusive club’: how AI is changing Omar Yaghi’s work
UC Berkeley’s reticular chemistry pioneer tells us about his new institute using AI to tackle climate change
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ResearchComputer simulations shed light on how material can shrink when heated
New theory offers insights into the origin of the very low and negative thermal expansion observed in cordierite
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OpinionCelebrating 100 years of the Pauli exclusion principle
How a quantum view of electron states enabled us to understand the stability of matter
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ResearchSimulations suggest why highly unsaturated molecules are so abundant in the interstellar medium
Shocks, cosmic rays and x-rays seem to ionise and fragment saturated molecules via mechanisms that result in structures with the highest possible number of π bonds
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OpinionRobots queuing up to fail
Claims of an AI revolution in drug discovery are missing the biggest problem