The Cl Functionalized Aluminum Nitride (AlN) and Aluminum Phosphide (AlP) Nanocone Sheets as Hydrogen Selenide (H2Se) Sensor: a Density Functional Investigation

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Density functional explorations of quadrupole coupling constants for BN, BP, AlN, and AlP graphene–like structures

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Density functional explorations of quadrupole coupling constants for BN, BP, AlN, and AlP graphene–like structures

Stabilizations and atomic level quadrupole coupling constant (CQ) properties have been investigated for graphene–like monolayers (G–monolayers) of boron nitride (BN), boron phosphide (BP), aluminum nitride (AlN), and aluminum phosphide (AlP) structures. To this aim, density functional theory (DFT) calculations have been performed to optimize the model structures and also to evaluate the CQ para...

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A successful management of aluminum phosphide intoxication.

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ژورنال

عنوان ژورنال: Acta Chimica Slovenica

سال: 2018

ISSN: 1318-0207

DOI: 10.17344/acsi.2017.3826