Interaction Energy, Counterpoise-Corrected Energy, and Charge Transfer Thiophene Characteristics as Basis for its Potential Use as a Gas Sensor: A Density Functional Theory Approach

Haripriya, P; Amrutha, R; Chandran, P

doi:10.2139/ssrn.4313989

SSRN Journal

2022

DOI: 10.2139/ssrn.4313989

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Interaction Energy, Counterpoise-Corrected Energy, and Charge Transfer Thiophene Characteristics as Basis for its Potential Use as a Gas Sensor: A Density Functional Theory Approach

P Haripriya

R Amrutha²,

P Chandran³

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Interaction Energy, Counterpoise-Corrected Energy, and Charge Transfer Thiophene Characteristics as Basis for its Potential Use as a Gas Sensor: A Density Functional Theory Approach

Cited by 1 publication

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Exploring the Sensitivity of Bowl-shaped Silicon Carbide Nanocluster towards G-Series Nerve Agents: A Density Functional Theory Approach

Exploring the Sensitivity of Bowl-shaped Silicon Carbide Nanocluster towards G-Series Nerve Agents: A Density Functional Theory Approach

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