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Results 1-10 of 44 (Search time: 0.001 seconds).
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Issue Date
Title
Author(s)
2006
Topics in dynamics, thermodynamics and electronic structure of supercooled liquids
Sastry, Srikanth
;
Sampangiraj, Ashwin S.
2006
Geometric phases, localized orbitals and distribution of electron charge centres
Waghmare, Umesh V.
;
Bhattacharjee, Joydeep
2006
Structural and vibrational consequences of reduced coordination
Narasimhan, Shobhana
;
Pushpa, Raghani
2001-09-22
Ab initio calculations on the anomalous thermal behaviour of fcc(110) surfaces
Narasimhan, Shobhana
2007-06-28
Lifting of Irˆ100‰ reconstruction by CO adsorption: An ab initio study
Ghosh, Prasenjit
;
Narasimhan, Shobhana
;
Jenkins, Stephen J
;
King, David A
2003-01
Exchange–correlation errors at harmonic and anharmonic orders: the case of bulk Cu
Pushpa, Raghani
;
Narasimhan, Shobhana
2008-06
Effect of coordination on bond properties: A first principles study
Paul, Jaita
;
Narasimhan, Shobhana
2003-01
Double stripe reconstruction of the Pt(111) surface
Pushpa, Raghani
;
Narasimhan, Shobhana
2008-05-12
Interplay between bonding and magnetism in the binding of NO to Rh clusters
Ghosh, Prasenjit
;
Pushpa, Raghani
;
de Gironcoli, Stefano
;
Narasimhan, Shobhana
2004-09-15
Symmetries, vibrational instabilities, and routes to stable structures of clusters of Al, Sn, and As
Pushpa, Raghani
;
Narasimhan, Shobhana
;
Waghmare, Umesh
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Author
31
Narasimhan, Shobhana
13
Pushpa, Raghani
9
Ghosh, Prasenjit
5
de Gironcoli, Stefano
4
Imam, Mighfar
4
Marathe, Madhura
3
Kahaly, Mousumi Upadhyay
3
Paul, Jaita
3
Waghmare, Umesh
2
Jenkins, Stephen J
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Metals
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Adsorption
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Growth
5
density functional theory
4
density functional calculations
4
Dynamics
4
Generalized Gradient Approximation
4
Pseudopotentials
3
Chemisorption
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copper
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