Items where Author is "Bartolotti, Libero J."

Article

Deshmukh, Milind M. ; Bartolotti, Libero J. ; Gadre, Shridhar R. (2011) Intramolecular hydrogen bond energy and cooperative interactions in α-, β-, and γ-cyclodextrin conformers Journal of Computational Chemistry, 32 (14). pp. 2996-3004. ISSN 0192-8651

Deshmukh, Milind M. ; Bartolotti, Libero J. ; Gadre, Shridhar R. (2007) Intramolecular hydrogen bonding and cooperative interactions in carbohydrates via the molecular tailoring approach Journal of Physical Chemistry A, 112 (2). pp. 312-321. ISSN 1089-5639

Deshmukh, Milind M. ; Gadre, Shridhar R. ; Bartolotti, Libero J. (2006) Estimation of intramolecular hydrogen bond energy via Molecular Tailoring Approach The Journal of Physical Chemistry A, 110 (45). pp. 12519-12523. ISSN 1089-5639

Kulkarni, Anant D. ; Babu, K. ; Gadre, Shridhar R. ; Bartolotti, Libero J. (2004) Exploring hydration patterns of aldehydes and amides: ab initio investigations Journal of Physical Chemistry A, 108 (13). pp. 2492-2498. ISSN 1089-5639

Pingale, Subhash S. ; Gadre, Shridhar R. ; Bartolotti, Libero J. (1998) Electrostatic insights into the molecular hydration process: a case study of crown ethers Journal of Physical Chemistry A, 102 (49). pp. 9987-9992. ISSN 1089-5639

Gejji, Shridhar P. ; Suresh, C. H. ; Bartolotti, Libero J. ; Gadre, Shridhar R. (1997) Electrostatic Potential as a Harbinger of Cation Coordination: CF3SO3- Ion as a Model Example The Journal of Physical Chemistry A, 101 (31). pp. 5678-5686. ISSN 1089-5639

Gejji, Shridhar P. ; Suresh, C. H. ; Bartolotti, Libero J. ; Gadre, Shridhar R. (1997) Electrostatic potential as a harbinger of cation coordination: CF₃SO₃- Ion as a model example Journal of Physical Chemistry A, 101 (31). pp. 5678-5686. ISSN 1089-5639

Bartolotti, Libero J. ; Gadre, Shridhar R. ; Parr, Robert G. (1980) Electronegativities of the elements from simple .CHI..alpha. theory Journal of the American Chemical Society, 102 (9). pp. 2945-2948. ISSN 0002-7863

Parr, Robert G. ; Gadre, Shridhar R. ; Bartolotti, Libero J. (1979) Local density functional theory of atoms and molecules Proceedings of the National Academy of Sciences of the United States of America, 76 (6). pp. 2522-2526. ISSN 0027-8424