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Shridhar Gadre
Shridhar Gadre
Distinguished Professor, SPPU, Pune
Verified email at iitk.ac.in
Title
Cited by
Cited by
Year
Local density functional theory of atoms and molecules
RG Parr, SR Gadre, LJ Bartolotti
Proceedings of the National Academy of Sciences 76 (6), 2522-2526, 1979
276541979
Structure and Stability of Water Clusters (H2O)n, n = 8−20:  An Ab Initio Investigation
S Maheshwary, N Patel, N Sathyamurthy, AD Kulkarni, SR Gadre
The Journal of Physical Chemistry A 105 (46), 10525-10537, 2001
5902001
Significant progress in predicting the crystal structures of small organic molecules–a report on the fourth blind test
GM Day, TG Cooper, AJ Cruz-Cabeza, KE Hejczyk, HL Ammon, ...
Acta Crystallographica Section B: Structural Science 65 (2), 107-125, 2009
4912009
Some novel characteristics of atomic information entropies
SR Gadre, SB Sears, SJ Chakravorty, RD Bendale
Physical Review A 32 (5), 2602, 1985
3061985
Electrostatics of atoms and molecules
SR Gadre, RN Shirsat
Universities Press, 2000
2822000
SCRF calculation of the effect of water on the topology of the molecular electrostatic potential
FJ Luque, M Orozco, PK Bhadane, SR Gadre
The Journal of Physical Chemistry 97 (37), 9380-9384, 1993
2441993
Molecular electrostatic potentials: A topographical study
SR Gadre, SA Kulkarni, IH Shrivastava
The Journal of chemical physics 96 (7), 5253-5260, 1992
2431992
Maximal and minimal characteristics of molecular electrostatic potentials
RK Pathak, SR Gadre
The Journal of chemical physics 93 (3), 1770-1773, 1990
2241990
Shapes and sizes of molecular anions via topographical analysis of electrostatic potential
SR Gadre, IH Shrivastava
The Journal of chemical physics 94 (6), 4384-4390, 1991
2191991
Molecular tailoring approach for simulation of electrostatic properties
SR Gadre, RN Shirsat, AC Limaye
The Journal of Physical Chemistry 98 (37), 9165-9169, 1994
2071994
Quantum chemical investigations on molecular clusters
SR Gadre, SD Yeole, N Sahu
Chemical reviews 114 (24), 12132-12173, 2014
1982014
An information theoretic synthesis and analysis of Compton profiles
SB Sears, SR Gadre
The Journal of Chemical Physics 75 (9), 4626-4635, 1981
1721981
Ab initio quality one‐electron properties of large molecules: Development and testing of molecular tailoring approach
K Babu, SR Gadre
Journal of computational chemistry 24 (4), 484-495, 2003
1652003
Clar's aromatic sextet theory revisited via molecular electrostatic potential topography
CH Suresh, SR Gadre
The Journal of Organic Chemistry 64 (7), 2505-2512, 1999
1491999
Information entropy and Thomas-Fermi theory
SR Gadre
Physical Review A 30 (1), 620, 1984
1481984
UNIVIS-2000: an indigenously developed comprehensive visualization package
AC Limaye, SR Gadre
Current Science 80 (10), 1296-1301, 2001
1372001
Electrostatic potential topology for probing molecular structure, bonding and reactivity
SR Gadre, CH Suresh, N Mohan
Molecules 26 (11), 3289, 2021
1362021
Ab initio structure and vibrational frequencies of (CF3SO2) 2N-Li+ ion pairs
SP Gejji, CH Suresh, K Babu, SR Gadre
The Journal of Physical Chemistry A 103 (37), 7474-7480, 1999
1271999
Electronegativities of the elements from simple. CHI.. alpha. theory
LJ Bartolotti, SR Gadre, RG Parr
Journal of the American Chemical Society 102 (9), 2945-2948, 1980
1271980
Topography of molecular scalar fields. I. Algorithm and Poincaré–Hopf relation
P Balanarayan, SR Gadre
The Journal of chemical physics 119 (10), 5037-5043, 2003
1252003
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