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Issue Date
Title
Author(s)
2018-07
EXPLORING THE STRUCTURE AND STABILITY OF Β-DIPEPTIDE – A QUANTUM CHEMICAL AND MOLECULAR DYNAMICS STUDY
A, Abiram
;
G, Praveena
2018-07-21
EXCITED STATES OF PNA BASE PAIRS – A THEORETICAL APPROACH
K, Indumathi
;
G, Praveena
2018-07-21
QUANTUM CHEMICAL STUDY ON THE XH…HM (X=-C2 H, -C2 H3 AND M= LI, NA, K, FE, ZN) DIHYDROGEN BOND SYSTEMS
J, Pavithra
;
G, Praveena
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Author
1
A, Abiram
1
J, Pavithra
1
K, Indumathi
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Ab initio
1
Conformers
1
density functional theory
1
DFT
1
Dihydrogen bond
1
DNA
1
Excitation energy and Oscillator ...
1
HOMO-LUMO gap
1
hydrogen storage
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metal hydrides
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