2022
DOI: 10.1007/978-981-19-2308-1_12
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Investigation on Thermodynamic Properties of Novel Ag2SrSn(S/Se)4 Quaternary Chalcogenide for Solar Cell Applications: A Density Functional Theory Study

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(1 citation statement)
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“…Density functional theory (DFT) is a widely employed method for investigating the structure-functionperformance relationship of passivators in PSCs due to its computational efficiency and acceptable accuracy [20][21][22][23][24][25][26] . In DFT, the exact form of exchange-correlation (XC) functional is unknown, necessitating approximations.…”
Section: Density Functional Theorymentioning
confidence: 99%
“…Density functional theory (DFT) is a widely employed method for investigating the structure-functionperformance relationship of passivators in PSCs due to its computational efficiency and acceptable accuracy [20][21][22][23][24][25][26] . In DFT, the exact form of exchange-correlation (XC) functional is unknown, necessitating approximations.…”
Section: Density Functional Theorymentioning
confidence: 99%