
Can SeqQuest perform phonon calculations?
Closed  Responses: 1
I was wondering if SeqQuest can do phonon calculations? If not, then is it being planned?
Thanks
amit
http://nanohub.org/answers/question/1711

evanscent modes considered?
Closed  Responses: 0
Does the simulation also include evanescent modes? (the “device” section is finite, evanescent waves should be able to couple transmission modes in the leads, right?)
http://nanohub.org/answers/question/1329

Debanjan Basu
http://nanohub.org/members/78136

Heeyuen Koh
http://nanohub.org/members/56621

IMA 2013 UQ: DFTbased Thermal Properties: Three Levels of Error Management
02 Apr 2014  Online Presentations  Contributor(s): Kurt Lejaeghere
It is often computationally expensive to predict finitetemperature properties of a crystal from densityfunctional theory (DFT). The temperaturedependent thermal expansion coefficient α, for...
http://nanohub.org/resources/20311