物理化学学报2018，Vol.34Issue(6)：699-707,9.DOI:10.3866/PKU.WHXB201711221
Analogies between Density Functional Theory Response Kernels and Derivatives of Thermodynamic State Functions
Analogies between Density Functional Theory Response Kernels and Derivatives of Thermodynamic State Functions
摘要
关键词
Conceptual DFT/Response kernels/Analogy with thermodynamics/Stability-concavity/convexityKey words
Conceptual DFT/Response kernels/Analogy with thermodynamics/Stability-concavity/convexity引用本文复制引用
GEERLINGS Paul,DE PROFT Frank,FIAS Stijn..Analogies between Density Functional Theory Response Kernels and Derivatives of Thermodynamic State Functions[J].物理化学学报,2018,34(6):699-707,9.基金项目
S.F. wishes to thank the Research Foundation Flanders (FWO) and the European Union’s Horizon 2020 Marie Sklodowska-Curie grant (No. 706415) for financially supporting his post-doctoral research at the ALGC group. F.D.P. and P.G. acknowledge the Research Foundation-Flanders (FWO) and the Vrije Universiteit Brussel (VUB) for continuous support to the ALGC research group, in particular the VUB for a Strategic Research Program awarded to ALGC, started up at January 1, 2013. F.D.P. also acknowledges the Francqui foundation for a position as Francqui Research Professor. （FWO）
