Debashree Manna

Debashree Manna

Institute of Organic Chemistry and Biochemistry CAS - Prague / Czech Republic
Natural Sciences / Chemical Sciences
AD Scientific Index ID: 4415310
Ústav organické chemie a biochemie CAS
person_outline Debashree Manna's MOST POPULAR ARTICLES
1-) Conventional and explicitly correlated ab initio benchmark study on water clusters: Revision of the BEGDB and WATER27 data sets D Manna, MK Kesharwani, N Sylvetsky, JML Martin Journal of chemical theory and computation 13 (7), 3136-3152, 2017 922017
2-) Non-covalent control of spin-state in metal-organic complex by positioning on N-doped graphene B de la Torre, M Švec, P Hapala, J Redondo, O Krejčí, R Lo, D Manna, ... Nature communications 9 (1), 2831, 2018 742018
3-) Actinide selectivity of 1, 10-phenanthroline-2, 9-dicarboxamide and its derivatives: a theoretical prediction followed by experimental validationD Manna, S Mula, A Bhattacharyya, S Chattopadhyay, TK GhantyDalton Transactions 44 (3), 1332-1340, 2015752015
4-) Complexation behavior of trivalent actinides and lanthanides with 1, 10-phenanthroline-2, 9-dicarboxylic acid based ligands: insight from density functional theoryD Manna, TK GhantyPhysical Chemistry Chemical Physics 14 (31), 11060-11069, 2012822012
5-) What Are the Ground State Structures of C20 and C24? An Explicitly Correlated Ab Initio ApproachD Manna, JML MartinThe Journal of Physical Chemistry A 120 (1), 153-160, 2016782016