Recently we developed a formalism for the scattering from linear and acyclic branched structures build of mutually non-interacting sub-units.{[}C. Svaneborg and J. S. Pedersen, J. Chem. Phys. 136, 104105 (2012){]} We assumed each sub-unit has referen...
Synchronization among globally coupled, chaotic map lattices can be related to stable periodic windows in isolated chaotic maps. This relation provides a simple predictive tool for the understanding of complicated behavior in coupled physical, chem...
It was known from Metropolis et al. [J. Chem. Phys. 21 (1953) 1087--1092] that one can sample from a distribution by performing Monte Carlo simulation from a Markov chain whose equilibrium distribution is equal to the target distribution. However, it...
Hey guys Chem here and another big download requested! GRID (2019) this one as normal is preinstalled as normal and is ready to play with all DLC, if any issues please install the _redist drivers!...
We perform a systematic application of the hybrid particle-field molecular dynamics technique [Milano et al, J. Chem. Phys. 2009, 130, 214106] to study interfacial properties and potential of mean force (PMF) for separating nanoparticles (NPs) in a m...
hi! im wondering if it'll be easier to take 14c in the spring with aguilar-romero (new prof?) or the online summer one with ow. does anyone know how the summer course is? i'm lowkey scared to take it ...
Dec 20, 2021 · 讲个笑话，某作者一篇文章2021年投了一圈先被Small拒，然后被 Chem Mater 拒，然后被 JMCA 拒，然后被Carbon拒，然后被 ACS Ami 拒，然后又被J power source拒，最后ASS终于送 …
From 1 July 2026, the names of companies submitting classification and labelling notifications will be published on ECHA CHEM Classification and labelling inventory, as required by the CLP Revision, …
From 1 July 2026, the names of companies submitting classification and labelling notifications will be published on ECHA CHEM Classification and labelling inventory, as required by the CLP Revision, …
The main aim of the present work is to improve the quality of the Etna volcanic ash fallout forecasts through the optimization of an integrated simulation system based on the Weather Research and Forecasting (WRF) model coupled with the WRF chemistry...
In parallel to the unified construction of relativistic Hamiltonians based solely on physical arguments [J. Chem. Phys. 160, 084111 (2024)], a unified implementation of relativistic wave function methods is achieved here via programming techniques (e...
Files used in TMP Chem videos on computational chemistry (⭐ 240)
Hi! I’m applying for a chemistry PhD at these schools but haven’t heard anything back MIT BU UCLA USC UC Berkeley Has anyone heard back from the chem department at these schools, I’m kin...
PLEASE I HAVEN'T STUDIED ANYTHING THIS YEAR I CAN'T RECALL ANYTHING FROM CLASSES BECAUSE GUESS WHAT FOR MORE THAN HALF THE YEAR WE DIDN'T HAVE PROPER CHEM CLASSES MY SCHOOL WAS ACTIVELY LOOKING F...
for context: i got rejected from med. so i got my third choice in nus which is pharmacy. so personally i absolutely love chem and bio. and i kinda still rlly wanna be a doctor. i’m considering tryin...
Implementation of Lilly Medchem Rules - J Med Chem 2012 (⭐ 98)
Droplets of a pure fluid, such as water, in an open container surrounded by gas, are thermodynamically unstable and evaporate quickly. In a recent paper [Archer et al. J. Chem. Phys. {\bf 159}, 194403 (2023)] we employed lattice density functional th...
Omg I dont know what to do. We finished our chem work, started smoking. We were cuddling watching dance moms. They said they wanted more cuddles, and pulled me into a very tight cuddle. It was so comf...
2′-bipyridine)ruthenium(II), (Ru(bpy)32+)/ Tri-n-propylamine (TPrA) System RevisitedsA New Route Involving TPrA•+ Cation Radicals". J. Am. Chem. Soc. 124 (48): 14478–14485
Recently, Trepte et al. [J. Chem. Phys., vol. 155, 2021] pointed out the importance of analyzing dipole moments in the Fermi-Löwdin orbital (FLO) self-interaction correction (SIC) for cyclic, planar molecules. In this manuscript, the effect of the m...