Publications of Dr. N. Sathyamurthy
1. Quasiclassical trajectory studies using 3D spline interpolation of ab initio surfaces,
N. Sathyamurthy and L. M. Raff, J. Chem. Phys. 63, 464-473(1975).
2. Comparison of quantum mechanical and quasiclassical scattering as a function of surface topology,
G. E. Kellerhals, N. Sathyamurthy and L. M. Raff, J. Chem. Phys. 64, 818-825(1976).
3. Quantum mechanical scattering studies using 2D spline interpolation of a potential-energy surface,
N. Sathyamurthy, G. E. Kellerhals and L. M. Raff, J. Chem. Phys. 64, 2259-2261(1976).
4. Reactive scattering calculations on a spline-fitted ab initio surface: He + H2+ → HeH+ + H reaction,
N. Sathyamurthy, R. Rangarajan and L. M. Raff, J. Chem. Phys. 64, 4606-4611(1976).
5. Inelastic scattering calculations in polyatomic systems using an ab initio intermolecular
potential-energy surface: The CO2(0,0,1,0) + H2(D2) → CO2(0,0,0,0) + H2(D2) system,
N. Sathyamurthy and L. M. Raff, J. Chem. Phys. 66, 2191-2211(1977).
6. Quantum mechanical scattering calculations on a spline-fitted ab initio surface: The He
+ H2+ (v = 0, 1, 2) → HeH+ + H reaction,
C. Stroud, N. Sathyamurthy, R. Rangarajan and L.M. Raff, J. Chem. Phys. Letters 48, 350-353(1977).
7. On the origin of the dynamical differences on the diatomics-in-molecules and spline-fitted ab initio surfaces for the He + H2+ reaction,
N. Sathyamurthy, J. W. Duff, C. Stroud and L.M. Raff, J. Chem. Phys. 67, 3563-3569(1977).
8. Rotational energy transfer (Theory) I. Comparison of quasiclassical and quantum mechanical results for elastic and rotationally inelastic HCl-Ar collisions,
J. C. Polanyi, N. Sathyamurthy and J. L. Schreiber, Chem. Phys. 24, 105-110(1977).
9. Rotational energy transfer (Theory) II. HCl + He, Ar,
J. C. Polanyi and N.Sathyamurthy, Chem. Phys. 29, 9-29 (1978).
10. Location of energy barriers VII. Sudden and gradual late-energy barriers,
J. C. Polanyi and N. Sathyamurthy, Chem. Phys. 33, 287-304(1978).
11. Effect of potential-well in an endothermic system: Reactive and vibrationally inelastic He + H2+ collisions,
N. Sathyamurthy, Chem. Phys. Letters 59, 95-99(1978).
12. Rotational energy transfer (Theory) III. HCl + HCl,
J. C. Polanyi and N. Sathyamurthy, J. Phys. Chem. 83, 978-983(1979).
13. Location of energy barriers VIII. Reagent → Product energy conversion on surfaces with sudden or gradual late-barriers,
J. C. Polanyi and N. Sathyamurthy, Chem. Phys. 37, 259-264(1979).
14. Reaction rate, rate constant and activation energy,
N. Sathyamurthy, Indian J. Chem. Edn. 6(2), 1-4(1979).
15. Inelastic scattering calculations in polyatomic systems using an ab initio intermolecular potential-energy surface II. Rotational energy transfer in CO2-H2 collisions,
N. Sathyamurthy and L. M. Raff, J. Chem. Phys. 72, 3163-3178(1980).
16. Exponential gap relation and the rotational inelasticity of H2-M systems,
C. Gayatri and N. Sathyamurthy, Chem. Phys. 48, 227-235(1980).
17. Molecular collisions and chemical reactions,
N. Sathyamurthy, Sci. Acad. Medal for Young Scientists - Lectures 1980, 17-20.
18. Negative activation energy for the Cl(Br)O + NO → Cl(Br)O + NO2 reactions,
A. Menon and N. Sathyamurthy, J. Phys. Chem. 85, 1021-1023(1981).
19. On the validity of the power gap law for rotational energy transfer in CO2-H2 collisions,
I. NoorBatcha and N. Sathyamurthy, Chem. Phys. Letters 79, 264-268(1981).
20. Importance of correlation energy in collision dynamics: Quasiclassical trajectory study of collinear He + H2+ (v') → HeH+ + H using HF and CI potential-energy surfaces, N. Sathyamurthy, Chem. Phys. 62, 1-19(1981).
21. Computer studies of molecular collisions and chemical reactions: A state-of-the-art survey,
N. Sathyamurthy, Curr. Sci. 50, 743-746(1981).
22. Effect of reagent rotation on cross section for the reaction Li + FH → LiF + H,
I. Noor-Batcha and N. Sathyamurthy, J. Am. Chem. Soc. 104, 1766-1767(1982).
23. Vibrational threshold equal to the barrier height for an endothermic reaction: Li + FH→ LiF + H on an ab initio potential-energy surface,
I. NoorBatcha and N. Sathyamurthy, J. Chem. Phys. 76, 6447-6449(1982).
24. The challenge of fitting ab initio surfaces I. Rigid rotor CO2-H2 potential,
C. P. Shukla, A. K. Bacchawat and N. Sathyamurthy, Chem. Phys. 70, 83-91(1982).
25. The challenge of fitting ab initio surfaces. A test of the utility of Akima's bivariate interpolation method to dynamical studies,
S. K. Upadhyay and N. Sathyamurthy, Chem. Phys.Letters 92, 631-636(1982).
26. Effect of the initial orientation of the reaction attributes for Li + FH → LiF + H on an ab initio surface,
I. NoorBatcha and N. Sathyamurthy, Chem. Phys. Letters 93, 432-435(1982).
27. Dynamics of a prototype alkali-hydrogen-halide exchange reaction on an ab initio potentialenergy surface,
I. NoorBatcha and N. Sathyamurthy, Chem. Phys. 77, 67-91(1983).
28. Effect of reagent rotation on elementary bimolecular exchange reactions,
N. Sathyamurthy, Chem. Rev. 83, 601-618(1983).
29.On the origin of the dynamical differences between the Tang and Dalgarno-Henry-Roberts potentials for rigid rotor H2-H collisions,
S. Margolies, B. A. Garetz and N. Sathyamurthy, J. Chem. Phys. 79, 2736-2741(1983).
30. Spectroscopy of the transition state (Theory) 3. Absorption by H3≠ in the three dimensional reaction H + H2,
H. R. Mayne, J. C. Polanyi, N. Sathyamurthy and S. Raynor, J. Phys. Chem. 88, 4064-4068(1984).
31. Three dimensional quasiclassical trajectory study of the reaction He + H2+ → HeH+ + H on an accurate ab initio potential-energy surface,
T. Joseph and N. Sathyamurthy, J. Chem.Phys. 80, 5332-5333(1984).
32. State-to-state chemistry: an ab initio approach,
N. Sathyamurthy, Proc. Indian Acad. Sci. (Chem. Sci.) 93, 449-457(1984).
33. Potential energy surface and molecular reaction dynamics,
N. Sathyamurthy and T. Joseph, J. Chem. Educ. 61, 968-971(1984).
34. Fitting repulsive potential-energy curves and surfaces,
S. Thareja and N. Sathyamurthy, J. Chem. Soc., Faraday Trans.2, 81, 717-723(1985).
35. Time-dependent wave mechanical study of the wings to the Lyman-α line in H + H2
reactive collisions,
P. M. Agrawal, V. Mohan and N. Sathyamurthy, Chem. Phys. Letters 114, 343-347(1985).
36. Rotational energy transfer in HF-Li collisions,
K.Raghavan, S. K. Upadhyay, N. Sathyamurthy and R. Ramaswamy, J. Chem. Phys. 83, 1573-1579(1985).
37. Computational fitting of ab initio potential-energy surfaces,
N. Sathyamurthy, Computer Phys. Rep. 3, 1-70(1985).
38. Quantum mechanical study of the collinear reaction He + H2+ → HeH+ + H,
T. Joseph and N. Sathyamurthy, J. Indian Chem. Soc. 62, 874-877(1985).
39. Time-dependent quantum mechanical approach to reactive scattering,
V. Mohan and N. Sathyamurthy, Current Sci. 55, 115-119(1986).
40. Absorption spectrum for the transition state H3≠ - A quantum mechanical model study,
S. Sinha, N. Sathyamurthy and K. Banerjee, Proc. Indian Acad. Sci.(Chem. Sci.) 96, 215- 221(1986).
41.On the origin of the dynamical threshold for collision-induced dissociation processes,
J. E. Dove, M. E. Mandy, N. Sathyamurthy and T. Joseph, Chem. Phys. Letters 127, 1-6(1986).
42. Dynamics of the endothermic reaction He + H2+→ HeH+ + H on an accurate ab initio
potential-energy surface,
T. Joseph and N. Sathyamurthy, J. Chem. Phys. 86, 704-714(1987).
43. Utility of the Sorbie-Murrell functional form in fitting the potential energy surface for
the ground and the lowest excited state of H3,
S. Thareja and N. Sathyamurthy, J. Phys. Chem. 91, 1790-1792(1987).
44. Nonlinear surprisal for product vibrational state distribution for the reaction Li + FH → LiF + H,
K. Raghavan, N. Sathyamurthy and R. D. Levine, J. Mole. Struct.(Theochem) 151, 385-390(1987).
45. Dynamics of a model six-center exchange reaction,
I. NoorBatcha, S. Thareja and N. Sathyamurthy, J. Phys. Chem. 91, 2171-2173(1987).
46. Kinematic effects in rotationally inelastic A + BC collisions,
K. Raghavan, N. Sathyamurthy and B. A. Garetz, Chem. Phys. 113, 187-199(1987).
47. Resonances in collinear He + H2+ collisions,
N. Sathyamurthy, M. Baer and T. Joseph, Chem. Phys. 114, 73-83(1987).
48. On the possibility of vibrational inhibition in a bimolecular exchange reaction,
C. P. Shukla, N. Sathyamurthy and I. P. Khuller, J. Chem. Phys. 87, 3251(1987).
49. Quantal wave packet calculations of reactive scattering,
V. Mohan and N. Sathyamurthy, Computer Phys. Rep. 7, 213-258(1988).
50. Investigation of the dependence of the Li2-Na potential hypersurface on mean internuclear Li-Li distance,
H.-G. Rubahn, N. Sathyamurthy and J. P. Toennies, Faraday Disc. Chem. Soc. 84, 356-357(1988).
51. Effect of reagent rotation on the reaction D + H2(v=1) → DH + H,
N. Sathyamurthy and J. P. Toennies, Chem. Phys. Letters 143, 323-328(1988).
52. Collision-induced dissociation: He + H2+ → He + H + H+, S. Kumar and N. Sathyamurthy, Indian J. Chem. Sci. 2, 1-5(1988).
53. Competition between exchange and dissociation processes in He + H2+ collisions,
S. Kumar and N. Sathyamurthy, Chem. Phys. 137, 25-32 (1989).
54. Isotopic branching: experiment versus theory for He + HD+ collisions,
K. C. Bhalla and N. Sathyamurthy, Chem. Phys. Lett. 160, 437-442 (1989).
55. Time-dependent quantum mechanical study of H2 chemisorption on W(001),
S. Thareja and N. Sathyamurthy, J. Indian Chem. Soc. special issue, 66, 596-598 (1989).
56. Fractals in molecule-surface collisions,
V. Balasubramanian, N. Sathyamurthy and J. W. Gadzuk, Surface Science Letters, 221, L741-749 (1989).
57. Maximization of entropy during a chemical reaction,
N. Balakrishnan and N. Sathyamurthy, Chem. Phys. Letters, 164, 267-269(1989).
58. Quasiclassical trajectory calculations of integral cross sections for highly vibrationally excited Li2-He,Kr systems,
H.-G. Rubahn and N. Sathyamurthy, Chem. Phys. Letters, 171, 506-512(1990).
59. Competition between dissociation and exchange processes: Contrasting dynamical behaviors in collinear H+H2 and He+H2+ collisions,
J. E. Dove, M. E. Mandy, V. Mohan and N. Sathyamurthy, J. Chem. Phys. 92, 7373-81(1990).
60. Reactivity bands and fractals in model H2-W(001) collisions,
S. Thareja and N. Sathyamurthy, Surface Science, 237, 266-272(1990).
61. Fractals in rotationally inelastic HF-Li collisions,
S. Kumar and N. Sathyamurthy, Chem. Phys. Letters, 175, 616-620(1990).
62. From alkali flames to automobile combustion: an illustration of the essential role of fundamental scientific research,
N. Sathyamurthy, Current Science, 59, 725-727(1990).
63. Time-dependent wavepacket methods for the calculation of collinear atom-diatom exchange reaction probabilities,
N. Balakrishnan and N. Sathyamurthy, Computer Physics Communications, 63, 209-215(1991).
64. Probing the transition state,
N. Sathyamurthy, in: Reaction Dynamics: Recent Advances, ed. N. Sathyamurthy, ch.2, Narosa, New Delhi and Springer-Verlag, Berlin (1991).
65. HeH2+ : A case study in ab initio dynamics,
N. Sathyamurthy, J. Indian Chem. Soc. 68, 17-20(1991).
66. Fractals and resonances in collinear atom-diatom collisions,
V. Balasubramanian and N. Sathyamurthy, Chemical Kinetics and Reaction Mechanism, ed. K.S. Gupta, RBSA Publishers, Jaipur (1991) p.73-79.
67. Fractals and resonances in collinear He + H2+ collisions,
V. Balasubramanian, B.K. Mishra, A. Bahel, S. Kumar and N. Sathyamurthy, J. Chem. Phys. 95, 4160-4167(1991).
68. Fractals in atomic and molecular collisions,
N. Sathyamurthy, Current Science, 61, 442- 446(1991).
69. Lasers in chemical reaction dynamics,
N. Sathyamurthy, in: Lasers in chemical and biological sciences, ed. P. Chopra and H.M. Chawla, Wiley Eastern, New Delhi(1992) p.19-29.
70. Order in disorder: the case of irregular scattering,
N. Sathyamurthy, Proc. 8th National workshop on atomic and molecular physics, Hyderabad Dec. 6-12, 1990 ed. A.P. Pathak, Narosa, New Delhi (1992).
71. Energy dependence of collision characteristics in molecule-surface collisions,
V. Balasubramanian, A. Bahel, I. P. Dubey, N. Sathyamurthy and J.W. Gadzuk, J. Phys. Chem. 96, 7870-7873(1992).
72. Chaos and fractals in the turning point search problem,
R. Chatterjee and N. Sathyamurthy, J. Chem. Phys. 97, 7006- 7007(1992).
73. State resolved scattering of molecules in pendular states: ICl + Ar,
B. Friedrich, H.-G. Rubahn and N. Sathyamurthy, Phys. Rev. Letters 69, 2487-2490(1992).
74. Resonances in collinear (He, H2+ ) collisions: A time-dependent quantum mechanical study,
N. Balakrishnan and N. Sathyamurthy, Chem. Phys. Letters 201, 294-300(1993).
75. Quasiclassical trajectory study of Li2 (v £ 25, j £ 100) - Na exchange reaction,
H.-G. Rubahn and N. Sathyamurthy, Mol. Phys. 78, 1047-1056(1993).
76. (He, H2+ ) Dynamics revisited,
S. Kumar, N. Sathyamurthy and K. C. Bhalla, J. Chem. Phys. 98, 4680-4689(1993).
77. Channel control in a chemical reaction. Vibrational enhancement of I*/I branching ratio in HI photodissociation,
C. Kalyanaraman and N. Sathyamurthy, Chem. Phys. Letters, 209, 52-56(1993).
78. Channel control in chemical reactions,
C. Kalyanaraman and N. Sathyamurthy, Current Sci. 65, 319-322(1993).
79. Three dimensional time-dependent quantum mechanical study of the reaction He + H2+ → HeH+ + H,
N. Balakrishnan and N. Sathyamurthy, Proc. Indian Acadn Sci. (Chem. Sci.), 106, 531-538(1994).
80. Collisional excitation of very high rotational levels of HF in small angle scattering with He+ at Elab = 25-50 eV,
T. Ruhaltinger, N. Sathyamurthy, J.P. Toennies and R.G. Wang, J. Chem. Phys., 100, 8877-8883(1994).
81. (He, H2+ ) Dynamics: A phase portrait analysis,
A. Rahaman and N. Sathyamurthy, J. Phys. Chem. 98, 12481-12485(1994).
82. Photodissociation and predissociation processes in OH: A time-dependent quantum mechanical study,
C. Kalyanaraman and N. Sathyamurthy, Chem. Phys. 187, 219-226(1994).
83. Possible reaction of atomic nitrogen with SFx(x=1-5) and CFx(x=1-3) fragments from
N2-SF6 and N2-CF4 discharges,
S.V.K. Kumar, N. Sathyamurthy, S. Manogaran and S.K. Mitra, Chem. Phys. Letters, 222, 465-470(1994).
84. Kinematic effects in chemical reactions,
I. NoorBatcha and N. Sathyamurthy, Malays. J. Sci. 15B, 35-40(1994).
85. Kinetic model for reduction of iron oxide in molten slags by iron-carbon melt,
A. Pal, B. Deo and N. Sathyamurthy, Steel Research, 65, 414-420(1994).
86. Correlation function approach to transition state resonances in collinear (He,H2+ ) collisions,
S. Mahapatra and N. Sathyamurthy, J. Chem. Phys. 102, 6057-6066(1995).
87. Time-dependent wave packet study of the collinear reaction He + H2+ → HeH+ + H,
N. Balakrishnan and N. Sathyamurthy, Chem. Phys. Letters, 240, 119-124(1995).
88. Transition state resonances in collinear (H─,H2) collisions,
S. Mahapatra, N. Sathyamurthy, S. Kumar and F. A. Gianturco, Chem. Phys. Letters, 241, 223-228(1995).
89. Photo-induced desorption
in NO/Pt: A time-dependent quantum mechanical study,
N. Chakrabarti, V. Balasubramanian, N. Sathyamurthy and J. W. Gadzuk, Chem.
Phys. Letters, 242, 490-498(1995).
90. Overcoming the zero point dilemma in quasiclassical trajectories - (He, H2+ ) as a test case,
S. Kumar, N. Sathyamurthy and R. Ramaswamy, J. Chem. Phys. 103, 6021-6028(1995).
91. Anomalous vibrational excitation in the small angle scattering of He+ from HCl at Elab = 20-60 eV,
T. Ruhaltinger, J. P. Toennies, R. G. Wang, S. Mahapatra and N. Sathyamurthy, J. Phys. Chem. 99, 15544-15550(1995).
92. Resonance Raman intensity analysis of polyatomic molecules,
N. Biswas, S. Umapathy, C. Kalyanaraman and N. Sathyamurthy, Proc. Indian Acad. Sci. (Chem. Sci.), 107, 233-244(1995).
93. Resonances in collinear H─ + H2 → H2 + H─ reaction: energy resolved reaction probabilities by the time-dependent wave packet approach,
S. Mahapatra and N. Sathyamurthy, J. Phys. Chem. 100, 2759-2761(1996).
94. Chemical systems,
N. Sathyamurthy, in: Complex Systems, ed. J. K. Bhattacharyya and A. K. Mallik, Narosa, New Delhi (1996), ch.4.
95. Quantum chaos in collinear (He,H2+ ) collisions,
S. Mahapatra, R. Ramaswamy and N. Sathyamurthy, J. Chem. Phys. 104, 3989(1996).
96. Collinear (He,HD+) and (He,DH+) collisions: transition state resonances and dynamics by time-dependent quantal wave packet approach,
S. Mahapatra and N. Sathyamurthy, J. Chem. Phys. 105, 10934(1996).
97. Possibility of proton oscillations through the benzene ring,
R. S. Shresth, R. Manickavasagam, S. Mahapatra and N. Sathyamurthy, Current Sci. 71, 49-50(1996).
98. Resonance deenhancement in the continuum Raman spectrum of HI,
N. Chakrabarti, C. Kalyanaraman and N. Sathyamurthy, Chem. Phys. Letters, 267, 31-36(1997).
99. Time-dependent quantum mechanical approach to reactive scattering and related processes,
N. Balakrishnan, C. Kalyanaraman and N. Sathyamurthy, Physics Reports, 280,79-144(1997).
100. Negative imaginary potentials in time-dependent quantum molecular scattering,
S. Mahapatra and N. Sathyamurthy, J. Chem. Soc. Faraday Trans. 93, 773-779(1997).
101. Resonances and chaos in the collinear collision system (He,H2+ ) and its isotopic variants,
S. Mahapatra, N. Sathyamurthy and R. Ramaswamy, Pramana, 47, 411(1997).
102. Autocorrelation function and its unifying role in structure and dynamics,
S. Mahapatra, N. Chakrabarti, C. Kalyanaraman and N. Sathyamurthy, in: Atomic and Molecular Physics,
ed. S.P. Khare, Deo Raj and A. Kumar, Bindra Publications, Ghaziabad, India, 1997, p.59-69.
103. Resonances in He + H2+ → HeH+ + H reaction in three dimensions: Energy resolved reaction probabilities by the time-dependent wave packet method,
S. Mahapatra and N. Sathyamurthy, J. Chem. Phys. 107, 6621(1997).
104. Photo-induced desorption of molecules from metal surfaces using femtosecond pulses: A model dynamical study,
N. Chakrabarti, N. Sathyamurthy and J.W. Gadzuk, J. Phys. Chem.A 102, 4154(1998).
105. Validation of photodissociation models using Raman excitation profiles: An application to IBr,
Vandana, K., N. Chakrabarti, N. Sathyamurthy and M. K. Mishra, Chem. Phys. Letters, 288, 545-552(1998).
106. Dynamics of the reaction He + H2+ → HeH+ + H on the Aguado-Paniagua surface,
S. Kumar, H. Kapoor and N. Sathyamurthy, Chem. Phys. Letters 289, 361-366(1998).
107. Classical mechanical investigations of collinear H─ + H2 →H2 + H─ dynamics,
W. H. Ansari and N. Sathyamurthy, Chem. Phys. Letters 289, 487-493(1998).
108. An interesting isotope effect in the Raman excitation profile for HI,
N. Chakarabarti and N. Sathyamurthy, J. Phys. Chem. A.102, 7089-7092(1998).
109. Exploring molecular motions in collinear HeH2+ and its isotopic variants using periodic orbits,
P. Bhatia, B. Maiti, N. Sathyamurthy, S. Stamatiadis and S. C. Farantos, Phys. Chem.Chem. Phys. 1, 1105-1113(1999).
110. Ground and excited state intramolecular proton transfer in salicylic acid: An ab initio electronic structure investigation,
S. Maheswari, A. Chowdhury, N. Sathyamurthy, H. B. Tripathi, M. Panda and J. Chandrasekhar, J. Phys. Chem A. 103, 6257-6268(1999).
111. Time correlation function and its unifying role in molecular structure and dynamics,
S. Mahapatra, N. Chakrabarti and N. Sathyamurthy, Int. Rev. Phys. Chem. 18, 235-262(1999).
112. Reduced potential energy curves for diatomic molecules and their respective cations,
R. Abrol, N. Sathyamurthy and M. K. Harbola, Chem. Phys. Letters 312, 341-345(1999).
113. Isotopic branching in (He,HD+) collisions: a time-dependent quantum mechanical study in three dimensions,
C. Kalyanaraman, D.C. Clary and N. Sathyamurthy, J. Chem. Phys. 111, 10910-10918(1999).
114. Possibility of proton motion through buckminsterfullerene,
S. Maheshwary, D. Chakraborty and N. Sathyamurthy, Chem. Phys. Letters 315, 181-186(1999).
115. Dynamics of (He, H2+ ) collisions,
B. Maiti and N. Sathyamurthy, Proc. Indian Natl. Sci. Acad. A. 66, 59-70(2000).
116. Periodic orbit analysis for HeH2+ in three dimensions,
B, Maiti, N. Sathyamurthy, S. Stamatiadis and S. C. Farantos, Indian J. Chem. 39A, 338-344(2000).
117. A time-dependent quantum mechanical investigation of dynamical resonances in three dimensional HeH2+ and HeHD+ systems,
B. Maiti, S. Mahapatra and N. Sathyamurthy, J. Chem. Phys. 113, 59-66(2000).
118. Photochromism and photoreactivity of 2,6-dichloro-4-methyl-3-pyridinecarboxaldehyde in the solid state,
T. K. Sarkar, S. K. Ghosh, J. N. Moorthy, J.-M. Fang, S. K. Nandy, N. Sathyamurthy and D. Chakraborty, Tetrahedron Letters 41, 6909-6913(2000).
119. Nonlinear phenomena in chemistry: channel control and mode selectivity in chemical reactions,
N. Sathyamurthy, in: Nonlinear Phenomena, ed. S. K. Malik, M. K. Chandrashekaran, N. Pradhan, Indian National Science Academy, New Delhi, 2000, pp. 931-946.
120. Photoinduced proton transfer in 3-hydroxy-2-naphthoic acid,
H. Mishra, H.C. Joshi, H. B. Tripathi, S. Maheshwari, N. Sathyamurthy, M. Panda and J. Chandrasekhar, J. Photochem. Photobiol. 139,23-36(2001).
121. Bound and quasibound states of HeH2+ and its isotopomers,
B. Maiti and N. Sathyamurthy, Chem. Phys. Letters 345, 461-470(2001).
122. Structure and stability of water clusters (H2O)n , n = 8-20: An ab initio investigation, S. Maheshwary, N. Patel, N. Sathyamurthy, A. D. Kulkarni and S. R. Gadre, J. Phys. Chem. A 105, 10525 - 10537(2001).
123. HeH2+ : A case study in time-dependent quantum mechanical approach to reactive scattering,
B. Maiti and N. Sathyamurthy, in: "Time-dependent quantum dynamics", Ed. S. C. Althorpe, P. Soldán and G. G. Balint-Kurti, CCP6, 2001 p. 32-35.
124. Rotational isomers of 1-methoxynaphthalene: A combined study by ultraviolet laser
spectroscopy in supersonic jet and ab initio theoretical calculation,
K. K. Mahato, A. Das, A. N. Panda, T. Chakraborty and N. Sathyamurthy, J. Phys. Chem. A106, 12058-12063, 2002.
125. Reaction probabilities and reaction cross sections for three dimensional He + H2+ (v) collisions: A time-dependent quantum mechanical study,
B. Maiti, C. Kalyanaraman, A. N. Panda and N. Sathyamurthy, J. Chem. Phys. 117, 9719-9726, 2002.
126. Time-dependent density functional theoretical study of low lying excited states of F2,
U. Lourderaj, M. K. Harbola and N. Sathyamurthy, Chem. Phys. Letters 366, 88, 2002.
127. Solid state photochemistry of methyl-substituted pyridine-3-carboxaldehyde. Conformational control, structure-reactivity correlation and uv-vis spectroscopic characterization of photo-enols,
Prasenjit Mal, U. Lourderaj, Parveen, P. Venugopalan, J. Narasimha Moorthy and N. Sathyamurthy, J. Org. Chem. 68(2003)3446.
128. Reactive scattering resonances in (He, H2+ ) collisions,
B. Maiti and N. Sathyamurthy, in: Current Developments in Atomic, Molecular and Chemical Physics with Applications, Ed. Man Mohan, Kluwer, 2003.
129. Theory of atom-diatom scattering,
N. Sathyamurthy, in Frontiers in Atomic, Molecular and Optical Physics, Vol. 3, Ed. S. C. Mukherjee and S. S. Bhattacharyya, Allied Publishers, New Delhi, 2003, p. 269-278.
130. Bound and quasibound states of He2 H+ and He2D+
A. N. Panda and N. Sathyamurthy, J. Phys. Chem. A 107, 7125-7131, 2003.
131. Possible explanation for the extended UV emission lines from helium-hydrogen plasma.
N. Sathyamurthy, Current Science, 85, 856, 2003.
132. Dynamics of (H-, H2) collisions: A Time-dependent quantum mechanical investigation on a new ab initio potential-energy surface,
A. N. Panda and N. Sathyamurthy, J. Chem. Phys. 121, 9343-9351(2004).
133. Chemical Reaction Dynamics: A time-dependent quantum mechanical approach
A. N. Panda and N. Sathyamurthy, Proc. Indian Natn. Sci.Acad. 70A, 635-648(2004).
134. Ab initio potential-energy surface for HeF2 in its ground electronic state
U. Lourderaj and N. Sathyamurthy, Chem. Phys. 308, 277-284(2005).
135. Time-dependent quantum mechanical wave packet study of the He + H2+(v,j) → HeH+ + H reaction
A. N. Panda and N. Sathyamurthy, J. Chem. Phys. 122, 054304(2005).
136. π-π interaction in pyridine
B. K. Mishra and N. Sathyamurthy, J. Phys. Chem. A 109, 6-8(2005).
137. Hydrogen bonding in phenol, water and phenol-water clusters,
R. Parthasarathi, V. Subramanian and N. Sathyamurthy, J. Phys. Chem. A 109, 843-850(2005).
138. Three dimensional quantum dynamics of (H-, H2) and its isotopic variants
A. N. Panda, K. Giri and N. Sathyamurthy, J. Phys. Chem. A 109, 2057-2061(2005).
139. An experimental and theoretical investigation of the photophysics of 1-hydroxy-2-naphthoic acid,
H. Mishra, S. Maheshwary, H. B. Tripathi and N. Sathyamurthy, J. Phys. Chem. A 109, 2746-2754(2005).
140. Stability in polysilanes for light emitting diodes,
A. Sharma, U. Lourderaj, Deepak, N. Sathyamurthy and M. Katiyar, Compu. Mat. Sci. 33, 206-211(2005).
141. Determination of stability and degradation in polysilanes by an electronic mechanism
A. Sharma, U. Lourderaj, Deepak and N. Sathyamurthy, J. Phys. Chem. B 109, 15860(2005).
142. Water clusters in a confined nonpolar environment
C. N. Ramachandran and N. Sathyamurthy, Chem. Phys. Letters 410, 348-351(2005)
143. Bowls, balls and sheets of boric acid clusters: The role of pentagon and hexagon motifs
M. Elango, R. Parthasarathi, V. Subramanian and N. Sathyamurthy, J. Phys. Chem. A 109, 8587-8593(2005).
144. Preferential scattering of one isotopomer over another in (He,HD+) collisions
A. K. Tiwari and N. Sathyamurthy, Chem. Phys. Letters. 414, 509-513(2005).
145. Atomic and molecular clusters: designer materials for the nanoworld
M. Elango, R. Parthasarathi, V. Subramanian, C. N. Ramachandran and N. Sathyamurthy, Proc. Indian Natn. Sci.Acad. 70A, xxx(2005).
146. Blue shift in X-H stretching frequency of molecules due to confinement
O. Shameema, C. N. Ramachandran and N. Sathyamurthy, J. Phys. Chem. A 110, 2-4(2006).
147. Isotopic branching in (He, HD+) collisions
A. K. Tewari, A. N. Panda and N. Sathyamurthy, J. Phys. Chem. A 110, 389-395(2006).
148. Ground and excited states of the monomer and dimer of certain carboxylic acids
U. Lourderaj and N. Sathyamurthy , J. Phys. Chem. A 110, 2709-(2006).
149. Hydrogen bonding without borders: an atoms-in-molecules perspective
R. Parthasarathi, V. Subramanian and N. Sathyamurthy, J. Phys. Chem. A 110, 3349-3351(2006).
150. Structure and stability of salicylic acid-water complexes and the effect of molecular hydration on the spectral properties of salicylic acid
A. K. Tewari and N. Sathyamurthy, J. Phys. Chem. A 110, 5960-5964(2006).
151. Hydrogen peroxide clusters: The role of open book motif in cage and helical structures
M. Elango, R. Parthasarathi, V. Subramanian, C. N. Ramachandran and N. Sathyamurthy, J. Phys. Chem. A 110, 6294-6300(2006).
152. Stacking interaction in pyrazine dimer
B. K. Mishra and N. Sathyamurthy, J. Theoretical and Computational Chemistry, 5, 609-619 (2006)
153. Beta-phenyl quenching of triplet-excited ketones: How critical is the geometry for deactivation?
S. Samanta, B. K. Mishra, T. C. S. Pace, N. Sathyamurthy, C. Bohne and J. N. Moorthy, J. Org. Chem. 71(2006)4453 - 4459.
154. Effect of reagent rotation on isotopic branching in (He, HD+) collisions
A. K. Tiwari and N. Sathyamurthy, J. Phys. Chem. A 110, 6294-6300(2006).
155. Ab initio quantum chemical investigation of the ground and excited states of salicylic acid dimer
Shruti Maheshwary, U. Lourderaj and N. Sathyamurthy, J. Phys. Chem. A 110, 12662-12669(2006).
156. Rotational excitation in ( H-, H2) collisions: a quantum mechanical study
K. Giri and N. Sathyamurthy, J. Phys. B: At. Mol. Opt. Phys. 39(2006)4123-4130.
157. Influence of reagent rotation on (H-, D2) and (D-, H2) collisions: A quantum mechanical study
K. Giri and N. Sathyamurthy, J. Phys. Chem. A 110(2006)13843-13849.
158. Introducing a twist in carbon nanotubes
C. N. Ramachandran and N. Sathyamurthy, Current Science, 91(2006)1503-1505.
159. Solvation of H3O+ by phenol: Hydrogen bonding vs. π complexation
R. Parthasarathi, V. Subramanian, N. Sathyamurthy and J. Leszczynski, J. Phys. Chem. A 111, 2-5(2007).
160. Van der Waals complexes of small molecules with benzenoid rings: Influence of multipole moments on their mutual orientation
B.K. Mishra and N.Sathyamurthy, J. Phys. Chem. A 111, 2139-2147(2007).
161. Time-Dependent Density Functional Theoretical Study of the Absorption Properties of BN – Substituted C60 Fullerenes
C. N. Ramachandran and N. Sathyamurthy, J. Phys. Chem. A 111, 6901-6903(2007)
162. Quantum dynamics of (H-, HD) collisions at low energies
K. Giri and N. Sathyamurthy, Chem. Phys. Letters, 444 (2007) 23-27.
163. Dissociative double ionization of CO2: Dynamics, energy levels and lifetime
V. Sharma, B.Bapat, J. Mondal, M. Hochlaf, K. Giri and N. Sathyamurthy, J. Phys. Chem. A 111, 10205-10211(2007).
164. Hydrogen bonding in protonated water clusters: An atoms in molecules perspective
R. Parthasarathi, V. Subramanian and N. Sathyamurthy, J. Phys. Chem. A 111, 13287-13290(2007).
165. Quantum chemical investigation of the reaction of O(3P2) with certain hydrocarbon radicals
A. Gupta, R. P. Singh, V. B. Singh, B. K. Mishra and N. Sathyamurthy, J. Chem. Sci. 119, 457-465(2007).
166. Electron density topography, NMR and NBO analysis of water clusters
R. Parthasarathi, V. Subramanian and N. Sathyamurthy,
Synthesis and Reactivity in Inorganic, Metal-Organic and Nano-Metal Chemistry, Special issue on water clusters, 38, 1-10(2008).
167. Importance of Coriolis coupling in isotopic branching in (He, HD+) collisions
A. K. Tiwari and N. Sathyamurthy, J. Phys. Chem. A – submitted.
168. Cation-π interaction: To stack or to spread
B. K. Mishra, V. K. Bajpai, V. Ramanathan, S. R. Gadre and N. Sathyamurthy, Mol. Phys. – submitted.
169. Synthesis of germanium encapsulated fullerene: a plausible photovoltaic material
D. Roy, N. K. Tripathi, K. Ram and N. Sathyamurthy, J.Am.Chem. Soc. – submitted.
170. The self-assembly of metaboric acid molecules into bowls and ball
M. Elango, V. Subramanian and N. Sathyamurthy, - to be submitted.
171. Intermolecular interaction in serotonin dimer and trimer
K. Giri and N. Sathyamurthy, J. Phys. Chem. A – to be submitted.
172. Effect of molecular hydration on structure, stability and spectral properties of formic acid, acetic acid and benzoic acid
K. Giri and N. Sathyamurthy - to be submitted.
173. Aromaticity in two and three dimensions
Pallavika Ramaswamy and N. Sathyamurthy – to be submitted.