Results 81 to 90 of about 40,512 (286)

The statistical ensemble of q-deformed hyperbolic modified P\"oschl-Teller potential for certain diatomic molecules through Euler-Maclaurin  approach

open access: yesJournal of Nigerian Society of Physical Sciences
The statistical properties are essentially needed to understand the macroscopic behaviours of atomic molecules, which is a crucial aspect of physics and chemistry research.
O. J. Olusesi   +2 more
doaj   +1 more source

Fear of grazing rivals the toxin‐inducing effects of nutrients in two marine harmful algae – a meta‐analysis

open access: yesBiological Reviews, EarlyView.
ABSTRACT One of the major subfields of chemical ecology is the study of toxins and how they mediate interactions between organisms. Toxins produced by harmful algae (phycotoxins) impact a wide variety of organisms connected to the marine food web. Significant research efforts have thus aimed to identify the ecological and evolutionary drivers behind ...
Milad Pourdanandeh, Erik Selander
wiley   +1 more source

Theoretical Spectroscopic Study for Some Diatomic Molecules

open access: yesIbn Al-Haitham Journal for Pure and Applied Sciences, 2017
      In this work, four electronic states ( ,   , and   ) of some diatomic molecules (InF and InCl) was studied by TD-DFT with energy represented by the exchange-correlation energy.
Adil Neama Ayyash
doaj  

CLASSICAL 1D LINEAR MODELS FOR INFRARED ABSORPTION AND ESTIMATES FOR THE VIBRATIONAL AMPLITUDES AND ENERGY OF NaCl IONIC COMPOUND [PDF]

open access: yesQuímica Nova
Sodium chloride, NaCl, was analyzed using two models based in classical physics with the main objective of verifying whether this ionic crystal is active or not to infrared absorption. The results from the first reduced mass linear diatomic model (RMLDM)
Jorge Corrêa de Araújo   +1 more
doaj   +1 more source

Tailoring Se‐Mediated Co‐Co Dual‐Atom Sites for Oxygen and Iodide Electrocatalysis Toward High‐Efficiency and Ultradurable Zinc‐Air/Iodide Hybrid Batteries

open access: yesCarbon Energy, EarlyView.
A Se‐mediated Co dual‐atom catalyst replaces sluggish oxygen evolution with efficient iodide oxidation in zinc‐air/iodide hybrid batteries. Se‐induced d‐p orbital hybridization optimizes adsorption, enabling a low 0.365 V voltage gap and superior durability, fundamentally overcoming conventional kinetic bottlenecks.
Huaipeng Pang   +6 more
wiley   +1 more source

Ambident Reactivity in the Phenyl + NO Radical Recombination

open access: yesChemistry – A European Journal, EarlyView.
ABSTRACT The recombination reaction of nitric oxide (NO) with radicals via its oxygen atom, rather than the more common nitrogen site, offers an intriguing pathway to the formation of oxynitrenes. The photochemical isomerization of nitroso compounds into their corresponding oxynitrenes may involve such a step.
Virinder Bhagat   +3 more
wiley   +1 more source

Possible role of microtubules in vesicular transport of matrix protein during sea urchin larval biomineralization

open access: yesDevelopmental Dynamics, EarlyView.
Abstract Background Biomineralization is a vital biological process through which organisms produce mineralized structures such as shells, skeletons, and teeth. Microtubules are essential for biomineralization in various eukaryotic species; however, their specific roles in this process remain unclear.
Areen Qassem   +2 more
wiley   +1 more source

Global Warming and Mass Extinctions Associated With Large Igneous Province Volcanism

open access: yesGeophysical Monograph Series, Page 83-102., 2021

Exploring the links between Large Igneous Provinces and dramatic environmental impact

An emerging consensus suggests that Large Igneous Provinces (LIPs) and Silicic LIPs (SLIPs) are a significant driver of dramatic global environmental and biological changes, including mass extinctions.
David P. G. Bond, Yadong Sun
wiley  

+1 more source

Extension of the correlation functions of molecular dynamics simulations using the reference interaction site model theory for diatomic molecules

open access: yesAIP Advances
The correlation functions obtained by molecular dynamics (MD) simulations for diatomic molecules were extended using the reference interaction site model (RISM) theory. The Lennard-Jones (LJ) and Coulomb potentials were employed as interaction potentials.
Tatsuhiko Miyata   +4 more
doaj   +1 more source

Unified Analytical Treatment of Molecular Energy Spectra and Thermodynamic Properties with the q-Deformed Tietz Model

open access: yesChemistry
A precise characterization of molecular vibrations and thermodynamic properties is essential for applications in spectroscopy, computational modeling, and chemical process design. In this study, the q-deformed Tietz (qDT) oscillator is applied to examine
Edwin S. Eyube   +6 more
doaj   +1 more source

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