DFT studies of small rare-gas clusters
Journal Title: PARIPEX-Indian Journal of Research - Year 2015, Vol 4, Issue 10
Abstract
Small rare gas clusters Rgn (n=3-7) has been studied at the DFT level using a fairly large basis set (aug-cc-pV5Z) and PBELYP functional. Potential energy curves of ground states over some interatomic distances have been plotted. Binding energy and equilibrium bond distance values agree with experimental findings.
Authors and Affiliations
Koushiki Gupta, Asoke P. Chattopadhyay
Keywords
Related Articles
- EP ID EP574101
- DOI -
- Views 73
- Downloads 0
Challenges Faced By Educated Unemployed Youth in India
In India, there has been an alarming phase of mass-unemployment among the educated youth. Post-graduates and graduates are walking pillar to post in search of employment. When there is slowdown in economy, there is surge...
SOFT SKILLS: ARE THEY EXISTED IN PUBLIC ADMINISTRATION?
Soft skills are different then hard skills. Hard skills are visible, accessible; soft skills are difficult to acquire,, difficult to adapt. Few skills could incorporative where as few are not. Corporate sector is more po...
Impact of Motivational Factors on Establishment of Enterprise in Mysore
Motivational factors play predominant role in establishment of enterprises in Mysore district. Mysore is one of the emerging industrial hubs of Karnataka. Accordingly, examining the factors influence the establishment of...
ROLE OF SELECTIVE TRADITIONAL GAMES FOR STRENGTH DEVELOPMENT OF COLLEGE STUDENTS
The purpose of this study was to determine the effect of selective traditional games in strength developing factor of college male students. For the purpose total sixty subjects were selected from the different colleges...
Prospective Assessment of Drug Prescribing Among Patients Admitted in General Medicine Department of a Tertiary Care Hospital in Ujjain.
A prospective observational study was conducted in Department of Pharmacology in collaboration with Department of Medicine, R. D. Gardi Medical College, Ujjain. The main aim of this study was to determine patterns of pre...