Protons accumulate at the graphene–water interface, with hydronium stabilized in the first contact layer, while hydroxide is partially excluded and distributed between surface and bulk regions.
Read it here 🔗 https://t.co/vbL1V9iBEZ
A fully funded PhD is now available to work on hydrogels for 3D printing, combining experiments and simulations to elucidate how molecular structure affects formulation rheology. Please apply asap: https://t.co/QtXjSRiaot
@esthergtb @MIF_UoL@livunieng
@wizzair I have paid for auto check-in but still aren't checked in with <50 hrs to departure. My phone number is in my profile. Is there a technical issue?
💥Join the @SossoGroup at @warwickchem 💥 We are looking for a Postdoc to work on a @LeverhulmeTrust-funded project titled: “Unlocking the Rational Design of Novel Pressure-transmitting Media”, in collaboration with @senngroup . Details at: https://t.co/SycVG8iM7R .
It's a great honor to be the Founding Editor-in-Chief of ACS Electrochemistry, and I look forward to building a forward-looking and distinct community around this new journal from the American Chemical Society. #ACSElectrochemistry
@TimothyDuignan Equilibrium constants for association would be the obvious way to determine how well the model captures these effects. These can be determined from the PMFs, and the simulations are relatively cheap.
11 PhD positions available in the EU NanoRAM ITN. Come and join us at the University of Warwick to develop an autonomous electrochemical probe microscope platform. Experience in programming (LabVIEW and image analysis beneficial). More info here:
https://t.co/QK5YVxgMpQ
We’re pleased to announce 65 Centres for Doctoral Training, supported with a £1 billion investment, that will equip the next generation of researchers to tackle key challenges such as AI, healthcare and quantum technologies: https://t.co/jMjHWkILhM #EPSRC_CDTs
We have a PhD opening within ht-MATTER - High-throughput modelling of Molecular crystals out-of-equilibrium - @uclchemeng!
If you are interested in molecular simulations, crystal nucleation, & statmech, get in touch!
RTs (RPs?) appreciated!
Details:
https://t.co/U1LuHH13Wz
See below an excellent opportunity to work with me and other researchers at NanoGUNE in a vibrant and international environment in the beautiful city of Donostia-San Sebastián. Contact me if you are interested in applying. The topic will be ML applied to molecular simulation.
Digitally designing crystallization processes from molecular structure. What does it entail & how close are we? These and other questions are addressed in this (rather extensive) collaborative work led by Chris Burcham @EliLillyandCo : https://t.co/s3TkoEWNn5
Estimating the convergence of MetaD usually requires a-posteriori analysis. Moreover the sampling obtained while tuning simulation parameters goes unused. Antoniu developed an approach (& code) to tackle these issues: https://t.co/91MtvReEer
@Realworldxstals@uclchemeng
In our latest work, we studied, using MD and OPES simulations, self-assembly of Janus-like MPCs forming directional linear & ring-like patterns
https://t.co/aRODnEoari
Well done👏 Anushna (MTech) and Vikas (PhD) @_Vikas_Tiwari_ would appreciate feedback @Chemistry_iitd@iitdelhi