|
 | Up a level |
Bhattarai, S and Sutradhar, D and Chandra, AK (2021) Tuning of halogen-bond strength: Comparative role of basicity and strength of σ-hole. In: Journal of Molecular Structure, 1223 .
Sutradhar, D and Bhattarai, S and Parveen, S and Chandra, AK (2020) Comparison between chlorine-shared and Halogen bonds involving substituted phosphabenzene and ClF molecules. In: ACS Omega, 5 (37). pp. 24095-24105.
Chandra, AK (2000) Asynchronous behaviour in some three-atom linear concerted radical-exchange reactions. In: Indian Journal of Chemistry - Section A: Inorganic, Physical, Theoretical and Analytical Chemistry, 39 (1-3). pp. 291-299.
Sengupta, Debasis and Chandra, AK (1999) Structure and stability of Li2F. In: Journal of Molecular Structure (Theochem), 492 (1-3). pp. 29-33.
Rao, Sreedhara V and Chandra, AK (1998) A Study of Bond-Cleavage and Bond-Formation Processes in Some Simple Metathesis Reactions. In: International Journal of Quantum Chemistry, 63 (6). pp. 1099-1106.
Chandra, AK and Rao, V Sreedhara (1998) Role of tunneling of hydrogen in the Norrish type II processes in a thione and a ketone. In: Journal of Photochemistry and Photobiology A: Chemistry, 115 (01). pp. 35-41.
Chandra, AK and Rao, Sreedhara V (1997) Two-dimensional tunneling of hydrogen in a Norrish type II process of a ketone. In: Chemical Physics Letters, 270 (1-2). pp. 87-92.
Rao, Sreedhara V and Chandra, AK (1997) An ab initio treatment of the Norrish type-II process in pentane-2-one and the role of tunneling of hydrogen. In: Chemical Physics, 214 (1). pp. 103-112.
Rao, Sreedhara V and Chandra, AK (1996) Photochemical intramolecular gamma-hydrogen abstraction in a ketone and an alkene and the role of tunneling of hydrogen. In: Journal of Photochemistry and Photobiology A: Chemistry, 101 (2-3). pp. 189-196.
Rao, Sreedhara V and Sengupta, Debasis and Chandra, AK (1996) Role of free valences and spin densities on the migrating atom in location of saddle points in radical-exchange reactions. In: Journal of Molecular Structure (Theochem), 361 (1-3). pp. 151-160.
Chandra, AK and Rao, Sreedhara V (1996) Nonperfect synchronization of bond-forming and bond-rupturing processes in the reaction $ H + H_2\longrightarrow H_2 + H $. In: International Journal of Quantum Chemistry, 58 (1). pp. 57-65.
Sreedhara Rao, V and Vijay, Amrendra and Chandra, AK (1996) A comparative study of the energetics, structures, and mechanisms of the HCN H HNC and LiCN <-> LiNC isomerizations. In: Canadian Journal Of Chemistry-Revue Canadienne De Chimie, 74 (06). pp. 1072-1077.
Chandra, AK and Rao, Sreedhara V (1995) Further examination of the BEBO model with the results of ab initio calculations of a reaction series. In: Chemical Physics, 200 (3). pp. 387-393.
Rao, Sreedhara V and Chandra, AK (1995) Reactions of cyanogen radical with alkanes and an explanation for negative temperature dependence of rate constants. In: Chemical Physics, 192 (3). pp. 247-254.
Sengupta, Debasis and Bhattacharyya, Anuradha and Sumathi, R and Chandra, AK (1995) Further studies on Norrish type II reactions including a reaction in the first excited singlet state and cyclization of 1:4 biradicals. In: Journal of Photochemistry and Photobiology A: Chemistry, 86 (1-3). pp. 161-170.
Sengupta, Debasis and Chandra, AK (1994) Role of the ${HN03}\leftrightarrow{NOH}$ lsomerization in reactions (i) $NH(^3\sum^-)+O(^3P)$ and (ii) $N(^4S)+OH(^2II):$ Ab inifio calculations and quantum statistical Rice-Ramsperger-Kassel analysis of the potential energy surfaces. In: Journal of Chemical Physics, 101 (5). pp. 3906-3915.
Sumathi, R and Chandra, AK (1994) Dissociation dynamics of acetyl chloride and cis-trans isomerisation of methoxychloro carbene and chlorohydroxymethyl carbene. In: Chemical Physics, 181 (1-2). pp. 73-84.
Sengupta, Debasis and Chandra, AK (1994) Role of tunneling of hydrogen in photoenolization of a ketone. In: International Journal of Quantum Chemistry, 52 (6). pp. 1317-1328.
Chandra, AK and Rao, VSR (1994) An examination of the BEBO model with the results of ab initio calculations of a reaction series. In: Chemical Physics, 187 (3). 297 -303.
Sumathi, R and Chandra, AK (1993) Photodecomposition of acetyl chloride on the excited singlet state surface. In: The Journal of Chemical Physics, 99 (9). pp. 6531-6536.
Sengupta, Debasis and Chandra, AK (1993) Studies on the Norrish type II reactions of aliphatic \alpha-diketones and the accompanying cyclization and disproportionation of 1:4 biradicals. In: Journal of Photochemistry and Photobiology A: Chemistry, 75 (2). pp. 151-162.
Sumathi, R and Chandra, AK (1993) Conformational Studies of Some Alpha-substituted Acetones CH3COCH2XCH3 Where X=CH2, O Or S And Phenacyl Sulfide. In: Journal of Molecular Structure (Theochem), 99 (1). pp. 49-58.
Chandra, AK and Rao, Sreedhara V (1993) Temperature dependence of hydrogen transfer reactions via tunneling at low temperatures. In: International Journal of Quantum Chemistry, 47 (6). pp. 437-448.
Sumathi, R and Chandra, AK (1992) Decomposition of formyl fluoride on the lowest triplet state surface. In: Chemical Physics, 165 (2-3). pp. 257-263.
Sengupta, D and Sumathi, R and Chandra, AK (1991) The Mechanism Of The Hydrogen Abstraction Process By Photo-Excited Ketones. In: New Journal of Chemistry, 15 (12). 901 -907.
Sengupta, Debasis and Sumathi, R and Chandra, AK (1991) Role of barriers to conformational changes in ketones undergoing the Norrish type II process. In: Journal of Photochemistry and Photobiology A: Chemistry, 60 (2). 149 -159.
Chandra, AK and Sumathi, R (1990) Mindo/3 configuration interaction studies of $\alpha$-cleavage processes in organic photochemistry. In: Journal of Photochemistry and Photobiology A: Chemistry, 52 (2). pp. 213-234.
Chandra, AK (1989) Excited-state structures of molecules with nearby electronic states. In: Journal of Molecular Structure: THEOCHEM, 202 . pp. 249-263.
Chandra, AK (1988) Photofragmentation In Non-Symmetric Carbonyl Compounds. In: Journal of Molecular Structure: Theochem, 181 (3-4). pp. 255-266.
Sumathi, K and Chandra, AK (1988) A comparative study of the photochemical hydrogen-abstraction reactions of a ketone and a thione. In: Journal of Photochemistry and Photobiology A: Chemistry, 43 (3). pp. 313-327.
Sumathi, K and Chandra, AK (1987) A theoretical study of the photochemical $\alpha$-cleavage processes in symmetric and nonsymmetric ketones. In: Journal of Photochemistry and Photobiology A: Chemistry, 40 (3). pp. 265-277.
Rao, CVR and Chandra, AK (1985) An investigation of bond formation in the weakly bound first excited 1Σ and lowest 3Σ states of HeH+. In: Chemical Physics Letters, 113 (4). pp. 391-394.
Bhanuprakash, K and Chandra, AK and Bhasu, Jyothi VC and Srikanthan, D (1984) Charge-resonance energies in dimer cations of aromatics. In: Molecular Physics, 52, Issue 3 June 1984 , pages - (3). pp. 733-741.
Chandra, AK and Rao, Rama V (1983) Normalization of the Kinetic Field Functions. In: Chemical Physics Letters, 102 (5). pp. 409-411.
Rao, Rama CV and Jacob, Chacko and Chandra, AK (1983) Hydrogen bonding in excited states of pyridine and pyrazine. In: Indian Journal of Chemistry, Section A: Inorganic, Physical, Theoretical & Analytical, 22A (3). pp. 183-185.
Chandra, AK (1982) Origin of the activation barrier in the process of hydrogen abstraction: the perturbation treatment. In: Journal of Photochemistry, 18 (2). pp. 151-159.
Chandra, AK (1982) Origin of the activation barrier in the process of hydrogen abstraction: the perturbation treatment. In: Journal of Photochemistry, 18 (2). pp. 151-159.
Chandra, AK (1981) Binding of three molecules in the excited state. In: Molecular Physics, 44 (4). 939 -943.
Jacob, Chacko and Chandra, AK (1981) Hydrogen bonding with mono- and di-carbonyls. In: Spectrochimica Acta Part A: Molecular Spectroscopy, 37 (12). pp. 1071-1077.
Malar, EJP and Chandra, AK (1980) Intermolecular interacton in the formation of dimers and excimers of naphthalene, anthracene and pyrene. In: Indian Journal of Chemistry - Section A: Inorganic, Physical, Theoretical and Analytical Chemistry, 19 (4). pp. 283-289.
Sebastian, KL and Chandra, AK (1979) A study of interaction in the lowest singlet and triplet states of H2. In: Proceedings of the Indian Academy of Sciences - Chemical Sciences, 88 (6). pp. 445-452.
Chandra, AK (1979) The perturbational treatment of the process of hydrogen abstraction by ketones. In: Journal of Photochemistry, 11 (5). pp. 347-360.
Sebastian, KL and Chandra, AK (1979) The short range interactions between two rare gas atoms. In: Pramana - Journal of Physics, 12 (1). pp. 9-18.
Chandra, AK and Sudhindra, BS and Vijayan, M and Ramasarma, T (1978) A theory on the migration of an extraneous electron across hydrogen bonds in polypeptides. In: Journal of Theoretical Biology, 74 (1). 1 -9.
Chandra, AK and Turro, NJ and Lyons Jr, AL and Stone, P (1978) The intramolecular external heavy atom effect in bromo-, benzo-, and naphthonorbornenes. In: Journal of the American Chemical Society, 100 (16). pp. 4964-4968.
Chandra, AK and Sebastian, KL (1978) A study of interactions in He2 1 in terms of the electronic forces. In: Molecular Physics, 36 (5). 1495-1502 .
Sudhindra, BS and Chandra, AK (1977) Binding in singlet-state and triplet-state excimers .2. Role of subjacent orbital interactions. In: Current science, 46 (12). pp. 406-409.
Chandra, AK and Sebastian, KL (1976) A study of interaction between two He+ ions in terms of the electronic forces. In: Chemical Physics Letters, 41 (3). pp. 593-597.
Sudhindra, BS and Chandra, AK (1975) Binding in singlet- and triplet-state excimers. In: Molecular Physics, 30 (1). pp. 319-324.
Chandra, AK and Sudhindra, BS (1974) Intermolecular interactions in the formation of aromatic hydrocarbon dimers. In: Molecular Physics, 28 (3). pp. 695-706.
Chandra, AK and Sundar, R (1972) Vibrational force constant and electron relaxation in H2 and Li2. In: Chemical Physics Letters, 14 (5). pp. 577-582.
