Matches in SemOpenAlex for { <https://semopenalex.org/work/W4246707074> ?p ?o ?g. }
- W4246707074 endingPage "274" @default.
- W4246707074 startingPage "263" @default.
- W4246707074 abstract "Abstract This chapter presents models for interatomic potentials in ionic materials. As for the other models described in this book, the derivations are based on density functional theory and the variational principle, which leads to all the commonly used types of model. The simplest model of all is the rigid ion model, or Born model. It is introduced here by changing the charges on the nuclei in a rare gas solid and applying first-order perturbation theory. To go beyond the rigid ion model the second-order functional derived previously is invoked. This leads to a class of models with deformable ions, the simplest example of which has the same structure as the classical shell model. Compressible ion and variable charge transfer models are discussed. Classical charge transfer models are seen as equivalent to self-consistent tight-binding model in which the effect of covalency is neglected." @default.
- W4246707074 created "2022-05-12" @default.
- W4246707074 creator A5004720419 @default.
- W4246707074 date "2003-10-23" @default.
- W4246707074 modified "2023-09-30" @default.
- W4246707074 title "Ionic Models" @default.
- W4246707074 cites W1501145371 @default.
- W4246707074 cites W1517089300 @default.
- W4246707074 cites W1549427706 @default.
- W4246707074 cites W1550186202 @default.
- W4246707074 cites W1635780468 @default.
- W4246707074 cites W1964846127 @default.
- W4246707074 cites W1965505432 @default.
- W4246707074 cites W1966094286 @default.
- W4246707074 cites W1966347424 @default.
- W4246707074 cites W1967882612 @default.
- W4246707074 cites W1968043076 @default.
- W4246707074 cites W1969891690 @default.
- W4246707074 cites W1972295667 @default.
- W4246707074 cites W1974363100 @default.
- W4246707074 cites W1975157420 @default.
- W4246707074 cites W1977328491 @default.
- W4246707074 cites W1977633159 @default.
- W4246707074 cites W1978716937 @default.
- W4246707074 cites W1980331104 @default.
- W4246707074 cites W1980972248 @default.
- W4246707074 cites W1981182065 @default.
- W4246707074 cites W1984112249 @default.
- W4246707074 cites W1985012653 @default.
- W4246707074 cites W1985549556 @default.
- W4246707074 cites W1985740490 @default.
- W4246707074 cites W1987947645 @default.
- W4246707074 cites W1988569870 @default.
- W4246707074 cites W1988681909 @default.
- W4246707074 cites W1988767416 @default.
- W4246707074 cites W1991862993 @default.
- W4246707074 cites W1991943470 @default.
- W4246707074 cites W1992028354 @default.
- W4246707074 cites W1993203441 @default.
- W4246707074 cites W1996425351 @default.
- W4246707074 cites W1996841058 @default.
- W4246707074 cites W1999398560 @default.
- W4246707074 cites W2000872531 @default.
- W4246707074 cites W2004660896 @default.
- W4246707074 cites W2005362016 @default.
- W4246707074 cites W2005740991 @default.
- W4246707074 cites W2007739411 @default.
- W4246707074 cites W2008809828 @default.
- W4246707074 cites W2009522011 @default.
- W4246707074 cites W2009872310 @default.
- W4246707074 cites W2010785223 @default.
- W4246707074 cites W2010960015 @default.
- W4246707074 cites W2012111359 @default.
- W4246707074 cites W2012478497 @default.
- W4246707074 cites W2013415561 @default.
- W4246707074 cites W2016022549 @default.
- W4246707074 cites W2016986183 @default.
- W4246707074 cites W2018181242 @default.
- W4246707074 cites W2021716666 @default.
- W4246707074 cites W2021779560 @default.
- W4246707074 cites W2022696619 @default.
- W4246707074 cites W2022917520 @default.
- W4246707074 cites W2024369059 @default.
- W4246707074 cites W2026333454 @default.
- W4246707074 cites W2026907619 @default.
- W4246707074 cites W2029143538 @default.
- W4246707074 cites W2030113971 @default.
- W4246707074 cites W2030266731 @default.
- W4246707074 cites W2030976617 @default.
- W4246707074 cites W2031124154 @default.
- W4246707074 cites W2032576009 @default.
- W4246707074 cites W2032971418 @default.
- W4246707074 cites W2033086537 @default.
- W4246707074 cites W2034124924 @default.
- W4246707074 cites W2036113194 @default.
- W4246707074 cites W2037777510 @default.
- W4246707074 cites W2038201676 @default.
- W4246707074 cites W2038533471 @default.
- W4246707074 cites W2039959185 @default.
- W4246707074 cites W2039998700 @default.
- W4246707074 cites W2040188171 @default.
- W4246707074 cites W2042108659 @default.
- W4246707074 cites W2043033779 @default.
- W4246707074 cites W2043984021 @default.
- W4246707074 cites W2046628089 @default.
- W4246707074 cites W2047102541 @default.
- W4246707074 cites W2049911308 @default.
- W4246707074 cites W2051693535 @default.
- W4246707074 cites W2052637367 @default.
- W4246707074 cites W2054926021 @default.
- W4246707074 cites W2058859550 @default.
- W4246707074 cites W2060604819 @default.
- W4246707074 cites W2060755008 @default.
- W4246707074 cites W2061369241 @default.
- W4246707074 cites W2062402464 @default.
- W4246707074 cites W2063730997 @default.
- W4246707074 cites W2063748146 @default.
- W4246707074 cites W2064489628 @default.