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Found 9 results
Filters: Keyword is total-energy calculations and Author is Mudring, A. V.  [Clear All Filters]
2018
V. Smetana, Mudryk, Y., Pecharsky, V. K., and Mudring, A. V., “Controlling magnetism via transition metal exchange in the series of intermetallics Eu(T1, T2)(5)In (T = Cu, Ag, Au)”, Journal of Materials Chemistry C, vol. 6, pp. 1353-1362, 2018.
M. L. Rhodehouse, Bell, T., Smetana, V., Mudring, A. V., and Meyer, G. H., “From the Nonexistent Polar Intermetallic Pt3Pr4 via Pt2-xPr3 to Pt/Sn/Pr Ternaries”, Inorganic Chemistry, vol. 57, pp. 9949-9961, 2018.
2017
I. Bigun, Smetana, V., Mudryk, Y., Hlova, I., Dzevenko, M., Havela, L., Kalychak, Y., Pecharsky, V., and Mudring, A. V., “EuNi5InH1.5-x (x=0-1.5): hydrogen induced structural and magnetic transitions”, Journal of Materials Chemistry C, vol. 5, pp. 2994-3006, 2017.
V. Smetana, Steinberg, S., and Mudring, A. V., “Layered Structures and Disordered Polyanionic Nets in the Cation Poor Polar Intermetallics CsAu1.4Ga2.8 and CsAu2Ga2.6”, Design, vol. 17, pp. 693-700, 2017.
I. Bigun, Steinberg, S., Smetana, V., Mudryk, Y., Kalychak, Y., Havela, L., Pecharsky, V., and Mudring, A. V., “Magnetocaloric Behavior in Ternary Europium Indides EuT5In: Probing the Design Capability of First-Principles-Based Methods on the Multifaceted Magnetic Materials”, Chemistry of Materials, vol. 29, pp. 2599-2614, 2017.
C. Celania, Smetana, V., Provino, A., Pecharsky, V., Manfrinetti, P., and Mudring, A. V., “R(3)Au(9)Pn (R = Y, Gd-Tm; Pn = Sb, Bi): A Link between Cu10Sn3 and Gd14Ag51”, Inorganic Chemistry, vol. 56, pp. 7247-7256, 2017.
2016
V. Smetana and Mudring, A. V., “Cesium Platinide Hydride 4Cs(2)Pt center dot CsH: An Intermetallic Double Salt Featuring Metal Anions”, Angewandte Chemie-International Edition, vol. 55, pp. 14838-14841, 2016.
2015
S. Steinberg, Card, N., and Mudring, A. V., “From the Ternary Eu(Au/In)(2) and EuAu4(Au/In)(2) with Remarkable Au/In Distributions to a New Structure Type: The Gold-Rich Eu5Au16(Au/In)(6) Structure”, Inorganic Chemistry, vol. 54, pp. 8187-8196, 2015.
A. Provino, Steinberg, S., Smetana, V., Kulkarni, R., Dhar, S. K., Manfrinetti, P., and Mudring, A. V., “Gold-rich R3Au7Sn3: establishing the interdependence between electronic features and physical properties”, Journal of Materials Chemistry C, vol. 3, pp. 8311-8321, 2015.