화학공학소재연구정보센터
검색결과 : 6건
No. Article
1 Energetics of melting of Yb2O3 and Lu2O3 from drop and catch calorimetry and first principles computations
Fyhrie M, Hong QJ, Kapush D, Ushakov SV, Liu H, van de Walle A, Navrotsky A
Journal of Chemical Thermodynamics, 132, 405, 2019
2 Simulations provide a rare look at real melting
van de Walle A
Science, 346(6210), 704, 2014
3 Predicted Electronic and Thermodynamic Properties of a Newly Discovered Zn8Sb7 Phase
Pomrehn GS, Toberer ES, Snyder GJ, van de Walle A
Journal of the American Chemical Society, 133(29), 11255, 2011
4 Free energies for acid attack reactions of lithium cobaltate
Benedek R, van de Walle A
Journal of the Electrochemical Society, 155(10), A711, 2008
5 A complete representation of structure-property relationships in crystals
Van De Walle A
Nature Materials, 7(6), 455, 2008
6 Ab initio modelling - Genesis of crystal structures
Van de Walle A
Nature Materials, 4(5), 362, 2005