The polymer-polymer interaction potential used in an earlier reported MD simulation of crystalline PEO [Neyertz, Brown and Thomas, J. Chem. Phys., 101, 10064 (1994)] is here transferred to the crystalline phase of poly(ethylene oxide)-sodium iodide, PEO,NaI. An appropriate set of ion-ion and ion-po
The phase behaviour of silver iodide. Constant stress molecular dynamics simulation
โ Scribed by Jeffery Tallon
- Publisher
- Elsevier Science
- Year
- 1988
- Tongue
- English
- Weight
- 155 KB
- Volume
- 28-30
- Category
- Article
- ISSN
- 0167-2738
No coin nor oath required. For personal study only.
โฆ Synopsis
The ~m ~ mat~r d~,2.m~ (MD) mbn,q~e m~ t~e Pardn~Rah~ L~ran~aa ~S ~e~ ~o iav~,~Atr the ph=e ~v~r of ~ u~ a ~p]e fi~oa model po=ati~. The systm of 216 or 256 ions ~ama~ i~fo~ o~ pure p~ t o anomer u~n s~ctmti~ or ~coo~ing, and t helmo~ ph~ diagram oFAgl h t~anaaCcably ~11 mlmlcked. m0G~ ~me autho~ B~veam~/~t adi~ Jn d~t ~nsiti~ ~ adiff~tdon ~don ia/he Vp~a~ dd~the ~t~ifon. Noe~fq~4for~i~Aheat~padty,~mpr~W~ndd~ud~ty,~yin~eaeh~m
๐ SIMILAR VOLUMES
In the 280 GHz region four rotational transitions of both isotopic species of AgJ in vibrational states up to u = 2 have been measured. The analysis inchtdii frequencies of former observations in the 10 GHz region resulted in improved and new Dunham parameters YkJ. From these data values of the vibr
## Abstract ChemInform is a weekly Abstracting Service, delivering concise information at a glance that was extracted from about 200 leading journals. To access a ChemInform Abstract, please click on HTML or PDF.