123 results on '"Pal, Sourav"'
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2. Development of design algorithm using MATLAB for flying wing UAVs.
3. Analysis of combustion performance for alternative fuel of a turbo-jet engine.
4. Relativistic double-ionization equation-of-motion coupled-cluster method: Application to low-lying doubly ionized states.
5. Relativistic coupled-cluster investigation of parity (P) and time-reversal (T) symmetry violations in HgF.
6. Relativistic equation-of-motion coupled-cluster method using open-shell reference wavefunction: Application to ionization potential.
7. Calculation of P,T-odd interaction constant of PbF using Z-vector method in the relativistic coupled-cluster framework.
8. Lifetime of inner-shell hole states of Ar (2p) and Kr (3d) using equation-of-motion coupled cluster method.
9. A new scheme for perturbative triples correction to (0,1) sector of Fock space multi-reference coupled cluster method: Theory, implementation, and examples.
10. Complex absorbing potential based equation-of-motion coupled cluster method for the potential energy curve of CO2- anion.
11. Ground state of naphthyl cation: Singlet or triplet?
12. Perturbative approximations to single and double spin flip equation of motion coupled cluster singles doubles methods.
13. Study of interatomic Coulombic decay of Ne(H2O)n (n = 1,3) clusters using equation-of-motion coupled-cluster method.
14. Equation-of-motion coupled-cluster method for the study of shape resonance.
15. First- and second-order electrical properties computed at the FSMRCCSD level for excited states of closed-shell molecules using the constrained-variational approach.
16. Calculation of vibrational energy of molecule using coupled cluster linear response theory in bosonic representation: Convergence studies.
17. Electronic structure of spherical quantum dots using coupled cluster method.
18. Interaction induced shifts in O–H stretching frequency of water in halide-ion water clusters: A microscopic approach with a bond descriptor.
19. Correlated complex independent particle potential for calculating electronic resonances.
20. Analytically continued Fock space multireference coupled-cluster theory: Application to the 2Πg shape resonance in e-N2 scattering.
21. A constrained variational approach for energy derivatives in Fock-space multireference coupled-cluster theory.
22. Fock space multireference coupled cluster calculations based on an underlying bivariational self-consistent field on Auger and shape resonances.
23. Density functional response approach for the linear and nonlinear electric properties of molecules.
24. A study of electronic and bonding properties of Sn doped Li[sub n] clusters and aluminum based binary clusters through electron localization function.
25. Mulliken population analysis based evaluation of condensed Fukui function indices using fractional molecular charge.
26. A diabatic states of ozone using Fock space multireference coupled clusters method.
27. On non-negativity of Fukui function indices.
28. Multireference coupled cluster based analytic response approach for evaluating molecular...
29. Correlated static-exchange interaction for electron–molecule scattering: Case study for LiH and H2.
30. Correlated static–exchange interaction calculation for e-+N2 scattering using the coupled cluster techniquea).
31. Multireference coupled-cluster method: Ionization potentials and excitation energies for ketene and diazomethane.
32. Molecular applications of multireference coupled-cluster methods using an incomplete model space: Direct calculation of excitation energies.
33. State-selective multireference coupled-cluster theory: In pursuit of property calculation.
34. Nonlinear molecular properties using biorthogonal response approach.
35. Lithium bonding interaction in H[sub 2]CY...LiF (Y=O,S) complexes: A theoretical probe.
36. Study of Molecular Vibration by Coupled Cluster Method: Bosonic Approach.
37. Partial Triples Excitation to the Fock Space Multi-reference Singles and Doubles: Dipole Moment of Doublet Radicals.
38. Search for parity and time reversal violating effects in HgH: Relativistic coupled-cluster study.
39. Constrained Variational Response to Fock-Space Multi-Reference Coupled-Cluster Theory: Formulation for Excited-State Electronic Structure Calculations and Some Pilot Applications.
40. Minimum magnetizability principle.
41. Influence of bond length variation on correlated static exchange potential: A case study in e-–N2 scattering.
42. Multireference coupled cluster calculations on CH2+.
43. A Lagrange multiplier approach for excited state properties through intermediate Hamiltonian formulation of Fock space multireference coupled-cluster theory.
44. Electronic transition dipole moments and dipole oscillator strengths within Fock-space multi-reference coupled cluster framework: An efficient and novel approach.
45. Vibrational multi-reference coupled cluster theory in bosonic representation.
46. Erratum: “Development of an efficient linear response approach to the Hilbert space multireference coupled-cluster theory” [J. Chem. Phys. 114, 1981 (2001)].
47. Dipole moments of adiabatic excited states using the Fock space multireference coupled-cluster analytic response approach.
48. Development of an efficient linear response approach to the Hilbert space multi-reference coupled-cluster theory.
49. On non-negativity of Fukui function indices. II.
50. Complex absorbing potential based equation-of-motion coupled cluster method for the potential energy curve of CO₂⁻ anion.
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