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T. Inerbaev, P. Gavryushkin, K. Litasov, F. Abuova, A. Akilbekov 1L.N. Gumilyov Eurasian National University, Astana, Kazakhstan; 2Center for Computational Quantum Chemistry, South China Normal University, Guangzhou 510006, China; 3Sobolev Institute of Geology and Mineralogy Siberian Branch Russian Academy of Sciences, Russia 4Novosibirsk State University, Russia (E-mail: talgat.inerbaev@gmail.com)

P-V-T equation of state and thermoelastic properties of shortite Na2Ca2(CO3)2 from first principles