Emory Univ.Professor, Editor-in-Chief @JChemPhys, ultrafast and nonlinear spectroscopy for solar energy conversion @LateNightLasers. The views here are my own.
JCP (@JChemPhys) 2022 Journal Impact Factor is 4.4, ranked in the first quartile ( Q1 ) of Chemical Physics Journals. Many thanks to our authors, readers, reviewers, editors, and AIPP (@AIP_Publishing ) for their contribution to the continuing improvement of the journal.
Looking for the @AIP_Publishing#earlycareer happy hour happening now to 5pm? Look for the 5-foot traffic cone, journal manager @Jendotherm! We're at the end of the 700s row in the expo hall #ACSFall2024
Our paper on the theory for proton-couples energy transfer (PCEnT) is now published in @JChemPhys! We developed a general theory for this recently discovered mechanism. Some applications are coming soon!
https://t.co/t0LytGDBsA
We are happy to report our new publication in @JChemPhys! We investigated the X-Ray absorption spectrum and the fragmentation of the tert-butyl radical after carbon 1s excitation at the @elettrasincro. Thanks to our partners in Denmark for the calculations
https://t.co/6H2xU2TgQZ
Check out our paper in @JChemPhys
We will use this tech beyond the diffraction limit to fabricate FULL-METAL chiral nanostructures.
"Anisotropic Growth of Au-Ag Heteronanostructures through Plasmon-Induced Reduction"
https://t.co/1LdzwgC5fy
FF-QD uses a hierarchy of approximations for a scalable approach to simulate excited state nuclear dynamics, promising to account for explicit environment effects during photochemical processes.
Learn more 👇
https://t.co/YAPfma6Och
A new and transparent formulation of time-dependent coupled cluster with dynamical basis functions, offering fully bivariational, numerically stable, and convergent dynamics. @ChemofClouds https://t.co/YAPfma6Och
Wondering how energy landscapes, which have fundamental importance in physics and chemistry, might be applied to broader fields of natural sciences and humanities?
Then read the latest perspective featured on the cover from J. C. Schön (@mpifkf)!
https://t.co/dQsyQ3CE2Y
The authors investigate the complex dynamical response of valence-limited fluids by computer simulations, finding a rich and fascinating behavior that can be traced back to the bonding process. @lrovigatti https://t.co/W61er2MuYx
Time-resolved electron diffraction elucidates the laser flash melting process that forms the basis of the emerging field of microsecond time-resolved cryo-EM. @UlrichJLorenz https://t.co/uUyCFRSJbJ
A summer treat from Filippo Bigi and @spozdn, now published on @JChemPhys. Fully local, kernel based #ML potentials that match the accuracy of equivariant message passing? With #wigner kernels, you can! https://t.co/94uthXN3tM
Team member and @NUChemistry graduate student Alex Krotz accounts for the optical lineshapes of MoS2 based on reciprocal-space quantum–classical dynamics. Out in @JChemPhys! Funding by @NSF.
https://t.co/efJBADn2jY
Learn how we achieved transferable long-time dynamics across the full range of tert-butanol/water mixture compositions with a single implicit solvent model. @VegtLab https://t.co/x8X7lLZV9E
🚨 i-PI 3.0 is out! 🚨
From 2x to 10x faster🏃 built-in ensemble propagation for #ML, driven MD, better docs & examples, and ofc all the best path integral algos - now also for bosons🤩
Read the (highlighted) @JChemPhys paper https://t.co/iEugwAtR9s
and update
pip install -U ipi
Pleased to announce that our paper titled "Boltzmann’s H-function for molecules with orientational degrees of freedom: Emergence of unique features" has been published in the Journal of Chemical Physics. Please read it here: https://t.co/d9OHkodRtG
@JChemPhys@BiologicalWater
We revisited the origin of nature of initial solvation, if relaxation happens via motion of freely moving or perturbated solvent molecules, giving rise to a Gaussian or an exponential component:
@JChemPhys@AIP_Publishing@DCS_IISERMOHALI@sakshi_chawla_
https://t.co/QVKAwslgEX