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Lead-free alternative cation (Ethylammonium) in organometallic perovskites for thermoelectric applications.
J Mol Model. 2024 Feb 20;30(3):77. doi: 10.1007/s00894-024-05867-7.
J Mol Model. 2024.
PMID: 38376612
Modeling and simulation of multifaceted properties of X2NaIO6 (X = Ca and Sr) double perovskite oxides for advanced technological applications.
Bairwa JK, Rani M, Kamlesh PK, Singh R, Rani U, Al-Qaisi S, Kumar T, Kumari S, Verma AS.
Bairwa JK, et al. Among authors: kamlesh pk.
J Mol Model. 2023 Nov 17;29(12):379. doi: 10.1007/s00894-023-05786-z.
J Mol Model. 2023.
PMID: 37978086
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Electronic structure, theoretical power conversion efficiency, and thermoelectric properties of bismuth-based alkaline earth antiperovskites.
Rani U, Kamlesh PK, Joshi TK, Singh R, Al-Qaisi S, Gupta R, Kumar T, Verma AS.
Rani U, et al. Among authors: kamlesh pk.
J Mol Model. 2023 Sep 30;29(10):329. doi: 10.1007/s00894-023-05732-z.
J Mol Model. 2023.
PMID: 37775579
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Progress in theoretical study of lead-free halide double perovskite Na2AgSbX6 (X = F, Cl, Br, and I) thermoelectric materials.
Kumari S, Kamlesh PK, Kumari L, Kumar S, Kumari S, Singh R, Gupta R, Chauhan MS, Rani U, Verma AS.
Kumari S, et al. Among authors: kamlesh pk.
J Mol Model. 2023 Jun 1;29(6):195. doi: 10.1007/s00894-023-05599-0.
J Mol Model. 2023.
PMID: 37261619
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Nowotny-Juza phase KBeX (X = N, P, As, Sb, and Bi) half-Heusler compounds: applicability in photovoltaics and thermoelectric generators.
Verma P, Singh C, Kamlesh PK, Kaur K, Verma AS.
Verma P, et al. Among authors: kamlesh pk.
J Mol Model. 2022 Dec 28;29(1):23. doi: 10.1007/s00894-022-05433-z.
J Mol Model. 2022.
PMID: 36575325
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