Results 31 to 40 of about 71,035 (324)
Observation of pendular butterfly Rydberg molecules
, 2016 Obtaining full control over the internal and external quantum states of molecules is the central goal of ultracold chemistry and allows for the study of coherent molecular dynamics, collisions and tests of fundamental laws of physics.
Eichert, Tanita +6 more
core +2 more sources
Effect of dipole polarizability on positron binding by strongly polar molecules [PDF]
, 2015 A model for positron binding to polar molecules is considered by combining the dipole potential outside the molecule with a strongly repulsive core of a given radius.
Gribakin, G. F., Swann, A. R.
core +2 more sources
Infrared vibrational spectra of CH3+ and its deuterated isotopologues
AIP Advances, 2019 We report a theoretical study of the infrared (IR) vibrational spectra of CH3+ and its deuterated isotopologues. We also report exothermicities for reactions of these species with HD and D2.
Gunnar Nyman, Hua-Gen Yu
doaj +1 more source
Monte Carlo configuration interaction applied to multipole moments, ionisation energies and electron affinities [PDF]
, 2013 The method of Monte Carlo configuration interaction (MCCI) [1,2] is applied to the calculation of multipole moments. We look at the ground and excited state dipole moments in carbon monoxide.
Coe, J. P. +2 more
core +2 more sources
Docking positrophilic electrons into molecular attractive potential of fluorinated methanes
, 2013 The present study shows that the positrophilic electrons of a molecule dock into the positron attractive potential region in the annihilation process under the plane-wave approximation.
Ma, Xiaoguang, Wang, Feng
core +2 more sources
Enhancing Potential of Trimethylamine Oxide on Atmospheric Particle Formation
Atmosphere, 2019 The role of an oxidation product of trimethylamine, trimethylamine oxide, in atmospheric particle formation is studied using quantum chemical methods and cluster formation simulations.
Nanna Myllys +3 more
doaj +1 more source
Excitons in hexagonal nanonetwork materials
, 2004 Optical excitations in hexagonal nanonetwork materials, for example, Boron-Nitride (BN) sheets and nanotubes, are investigated theoretically. A permanent electric dipole moment, whose direction is from the B site to the N site, is considered along the BN
Harigaya, Kikuo
core +1 more source
Ab initio calculations to support accurate modelling of the rovibronic spectroscopy calculations of vanadium monoxide (VO) [PDF]
, 2016 Accurate knowledge of the rovibronic near-infrared and visible spectra of vanadium monoxide (VO) is very important for studies of cool stellar and hot planetary atmospheres. Here, the required ab initio dipole moment and spin-orbit coupling curves for VO
McKemmish, Laura K. +2 more
core +3 more sources
Purification tags markedly affect self‐aggregation of CPEB3
FEBS Letters, EarlyView.Although recombinant proteins are used to study protein aggregation in vitro, uncleaved tags can interfere with accurate interpretation. Our findings demonstrate that His₆‐GFP and His₁₂ tags significantly affect liquid droplet and amyloid fibril formation in the intrinsically disordered region (IDR) of mouse cytoplasmic polyadenylation element‐binding ...
Harunobu Saito +6 more
wiley +1 more source
Advanced Engineering Materials, EarlyView.This study explores aerosol jet‐printed (AJP) surface roughness, its effects on the performance of microwave electronics, and its process contributors. First, an electromagnetic model is vetted for AJP's unique roughness signature. Simulations are built which show process‐induced roughness is as significant as conductor resistivity in driving microwave
Christopher Areias, Alkim Akyurtlu
wiley +1 more source