Neepa Maitra's Publications

Last updated: Apr, 2008.

In reverse chronological order: (in pdf)

(29) Comment on “Critique of the foundations of time-dependent density functional theory [Phys. Rev. A 75, 022513 (2007)]“
        N. T. Maitra, R. van Leeuwen, and K. Burke, Phys. Rev. A (to appear).

 (28) Comment on “Analysis of Floquet formulation of time-dependent density functional theory [Chem. Phys. Lett. 433 (2006) 204]“
        N. T. Maitra, and K. Burke, Chem. Phys. Lett. 441, 167 (2007).

(27)  Investigating interaction-induced chaos using time-dependent density functional theory
        A. Wasserman, N. T. Maitra, and E.J. Heller, Phys. Rev. A. 77, 042503 (2008).

(26) An improved exchange-correlation potential for polarizabilities and dissociation in DFT
        N. T. Maitra and M. van Faassen, J. Chem. Phys. 127, 191106 (Rapids) (2007).

(25) On electron-nuclear correlation using time-dependent density functional theory
        N. T. Maitra, J. Chem. Phys. 125, 014110 (2006).

(24) Long-range excitations in time-dependent density functional theory
        N. T. Maitra and D. G. Tempel, J. Chem. Phys. 125, 184111 (2006).

(23) Undoing static correlation: long-range charge transfer in time-dependent density functional theory
        N. T. Maitra,  J. Chem. Phys. 122, 234104 (2005).         

(22) Initial-state dependence and memory

       N. T.  Maitra, in Time-Dependent Density Functional Theory, eds. M.A.L. Marques et al. (Springer, Berlin 2006).              


(21) Continuum states from time-dependent density functional theory
        A. Wasserman, N.T. Maitra, and K. Burke,  J. Chem. Phys. 122, 133103 (2005).

(20) Memory formula for perturbations in time-dependent density functional theory
        N.T. Maitra, Int. J. Quant. Chem. 102, 573 (2005).

(19) Double excitations within time-dependent density functional theory linear response
        N.T. Maitra, F. Zhang, R.J. Cave, and K. Burke, J. Chem. Phys. 120, 5932 (2004).

(18) A dressed time-dependent density functional treatment of the $2^1 A_g$ States of butadiene and hexatriene
        R.J. Cave, F. Zhang, N.T. Maitra, and K. Burke, Chem. Phys. Lett. 389, 39 (2004).

(17) Local density approximation can yield accurate excitations to Rydberg states
        A. Wasserman, N.T. Maitra, and K. Burke, Phys. Rev. Lett. 91, 263001 (2003).

(16) Current-density functional theory of the response of solids
        N.T. Maitra, I. Souza, and K. Burke, Phys. Rev. B 68, 045019 (2003).

(15) On the Floquet formulation of time-dependent density functional theory
        N.T. Maitra, and K. Burke, Chem. Phys. Lett. 359, 237 (2002).

(14) Memory in time-dependent density functional theory
        N.T. Maitra, K. Burke, and C. Woodward, Phys. Rev. Lett. 89, 023002 (2002).

(13) Correlation in time-dependent density functional theory
        P. Hessler, N.T. Maitra, and K. Burke, J. Chem. Phys. 117, 72 (2002) .

(12) What is time-dependent density functional theory? Successes and Challenges
        N.T. Maitra, A. Wasserman, and K. Burke, in Proceedings of the Rodes conference in DFT , ed. A. Gonis (Kluwer) (2001).

(11) Ten topical questions in time-dependent density functional theory
        N.T. Maitra, K. Burke, H. Appel, E.K.U. Gross and R. van Leeuwen, in Reviews of Modern Quantum Chemistry: A Celebration of the Contributions of R.G. Parr , ed. K.D. Sen (World-Scientific) (2002).

(10) Demonstration of initial-state dependence in density functional theory
        N.T. Maitra and K. Burke, Phys. Rev. A. 63 042501 (2001); erratum 64 039901 (E) (2001).

(9) The pair density in approximate density functionals: the hidden agent
        N.T. Maitra and K. Burke, in Many-Electron Densities and Reduced Density Matrices , ed. J. Cioslowski (Kluwer, New York) (2000).

(8) Semiclassical maps: A study of classically forbidden transitions, sub-h structure, and dynamical localization
        N.T. Maitra J. Chem. Phys. 112, 531 (2000).

(7) Quantum transport through cantori
        N.T. Maitra and E. J. Heller, Phys. Rev. E 61, 3620 (2000).

(6) Semiclassical amplitudes: Supercaustics and the whisker map}
        N.T. Maitra and E. J. Heller, Phys. Rev. A 61, 012107 (2000).

(5) Quantizing constrained systems
        L. Kaplan, N.T. Maitra and E. J. Heller, Phys. Rev. A 56, 2592 (1997).

(4) Barrier tunneling and reflection in the time and energy domains: the battle of the exponentials
        N.T. Maitra and E. J. Heller, Phys. Rev. Lett. 78, 3035 (1997).

(3) Tunneling and the semiclassical propagator: a new perspective
        N.T. Maitra and E. J. Heller, in Classical, Semiclassical and Quantum Dynamics in Atoms, Springer Lecture Notes in Physics, Ed. by H. Friedrich and B. Eckhardt, Berlin, pp. 94 - 111 (1997)

(2) Ergodic properties of quantized toral automorphisms
       S. Klimek, A. Lesniewski, N. Maitra, R. Rubin, J. Math. Phys. 38 (1), 67 (1997).

(1) Semiclassical perturbation approach to quantum reflection
        N.T. Maitra and E. J. Heller, Phys. Rev. A 54, 4763 (1996).

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