131 results on '"Aubert-Frecon, M."'
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2. Static electric dipole polarizabilities of alkali clusters
3. A quantum mechanics-based approach for optimization of metabolite basis-sets. Application to quantitation of HRMAS-NMR signals
4. DFT calculations of isomer effects upon NMR spin-Hamiltonian parameters of prostate polyamines
5. DFT calculations of 1H chemical shifts, simulated and experimental NMR spectra for sarcosine
6. Ab initio potential energy curves and transition dipole moments for the interaction of a ground state He with Na(3s–3p)
7. Self-broadening and shifting of the Li(2 s–2 p) and K(4 s–4 p) line cores
8. Theoretical and experimental investigation of the 1H NMR spectrum of putrescine
9. Charge transfers in mixed silicon–alkali clusters and dipole moments
10. Theoretical study of mixed silicon-lithium clusters Si(sub n)Li(sub p)(super +) (n = 1-6, p = 1-2)
11. Permanente dipole of metal-benzene molecules: evidence for long-range weakly bound states?
12. Electric dipole, polarizability and structure of cesium chloride clusters with one-excess electron
13. Non perturbative approach for a polar and polarizable linear molecule in an inhomogeneous electric field: Application to molecular beam deviation experiments
14. Model potential calculations for various electronic excited states of Li (super)- and Na (super)-
15. Theoretical structure of the low lying electronic states of yttrium fluoride YF
16. Theoretical electronic structure including spin–orbit effects of the alkali dimer cation [formula omitted]
17. Theoretical electronic structure of the lowest-lying states of the YI molecule
18. Existence of weakly bound states for metal–benzene molecules confirmed from a long-range model
19. Theoretical spin-orbit structure of the alkali dimer cation K2+
20. Theoretical electronic structure of the lowest-lying states of the LaCl molecule
21. Experimental and theoretical investigation of the [formula omitted] and [formula omitted] states of K 2
22. Theoretical electronic structure of the alkali-dimer cation Rb 2+
23. Theoretical electronic structure of the lowest-lying states of the LaI molecule
24. Static dipolar polarizabilities for various electronic states of alkali atoms
25. Theoretical Study of the Electronic Structure of the KRb Molecule
26. Potential Energies, Permanent and Transition Dipole Moments for Numerous Electronic Excited States of NaK
27. Theoretical study of the electronic structure of the LiRb and NaRb molecules
28. Potential energies of the 41Π and 51Π states of NaK by polarization labelling spectroscopy and by ab initio calculations
29. Potential energy curves of 58 states of Li 2+
30. Theoretical study of the electronic structure of KLi and comparison with experiments
31. Effective reduced mass calculated in a non-minimal basis set within a non-adiabatic formulation of the ground state hydrogen atoms interaction problem
32. Prolate Spheroidal Wavefunctions
33. The (1)1...g state of 39K2 revisited.
34. Computed electron affinity of carbon clusters C(sub n) up to n = 20 and fragmentation energy of anions
35. Model potential calculations for the ground and various excited states of LiNa(super +)
36. Diffuse and triplet satellite bands of KRb molecule
37. Experimental and theoretical investigations of ionization potentials and structures of mixed sodium lithium clusters
38. Theoretical study of the electronic structure of the low-lying states of the Li2H molecule
39. Perturbation model for the X1 Σ+ and a3 Σ+ states of NaK at intermediate internuclear distances beyond 6 Å
40. Effective reduced mass for the interaction of two ground state hydrogen atoms in a non-adiabatic Heitler-London approximation
41. Structures in the long range potential curves of the Na2molecule: comparison between ab initio and asymptotic calculations
42. Exact solutions of a hydrogenic system in a half space: application to image-charge model calculations for atomic hydrogen physisorption
43. Semi-empirical model potentials for the interaction between two O2 ground state molecules
44. The Killingbeck-Miller method for the treatment of a hydrogenic system in a half space
45. Structural electric dipole in small ionic nanocrystals
46. Determination of heteronuclear diatomic orbitals in terms of spherical harmonics from Miller's algorithm
47. Static electric dipole polarizabilities of alkali clusters.
48. Pure long-range ion-pair Cs 2 molecules
49. Diffuse bands of Rb[sub 2] molecule: Detection of ultracold Rb[sub 2].
50. Triplet satellite bands of KRb molecule in the far blue wings of K and Rb resonance lines.
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