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Rajappa, Chitra and Sringeri, Bhuvaneshwari S and Subramanian, Yashonath and Gopalakrishnan, J (2014) A molecular dynamics study of ambient and high pressure phases of silica: Structure and enthalpy variation with molar volume. In: JOURNAL OF CHEMICAL PHYSICS, 140 (24).
Rajappa, Chitra and Krause, C and Borah, BJ and Adem, Z and Galvosas, P and Kaerger, J and Subramanian, Y (2013) Diffusion of pentane isomers in faujasite-type zeolites : NMR and molecular dynamics study. In: MICROPOROUS AND MESOPOROUS MATERIALS, 171 . pp. 58-64.