1999
- BERTHA - 4-component relativistic molecular quantum
mechanics, in Supercomputers, Collision Processes and
Applications , edited by K. L. Bell, K. A. Berrington,
D. S. F. Crothers and K. T. Taylor, pp. 213-224 (Plenum, New York, 1999).
1998
- Relativistic, quantum electrodynamic and many-body effects
in the water molecule, H. M. Quiney, H. Skaane and
I. P. Grant, Chem. Phys. Letts.
290, 473-480 (1998).
- Oscillator strength anomalies in the neon isoelectronic
sequence with applications to X-ray laser modelling,
E. P. Ivanova and I. P. Grant, J. Phys. B:
At. Mol. Opt. Phys. 31, 2871-2884 (1998).
- Hyperfine and PT-odd effects in YbF doublet
Sigma, H. M. Quiney, H. Skaane and
I. P. Grant, J. Phys. B: At. Mol. Opt. Phys.
31 , L85-95 (1998).
- Electron scattering from atomic targets. Application of
Dirac R-matrix theory, by W. Wijesundera,
I. Grant and P. Norrington
In Many-Body Atomic Physics, edited by J. J. Boyle and
M. S. Pindzola, pp. 325-348. (Cambridge University Press, 1998).
- Ab initio relativistic quantum chemistry: four components
good, two-components bad! H. M. Quiney, H. Skaane and
I. P. Grant, Adv. Quant Chem.
32, 1-49 (1998).
(Thematic volume:
Quantum Systems in Chemistry and Physics, Guest Editors: S.
Wilson, P. J. Grout, R. McWeeny, J. Maruani and Y. G. Smeyers).
1997
- Nuclear quadrupole moment of scandium, J. Bieron,
I. P. Grant and C. F. Fischer, Phys. Rev. A
56 , 316- (1997)
- Generation of Optimized FORTRAN Code for Molecular Integrals
of Gaussian-Type Functions, T. C. Scott, I. P. Grant
, M. B. Monagan and V. R. Saunders, MapleTech.
4 , No. 2, 15-24 (1997).
- Relativistic calculation of electromagnetic interactions
in molecules , H. M. Quiney, H. Skaane and
I. P. Grant,J. Phys. B: At. Mol. Opt. Phys.
30 , L829-834 (1997).
- Dirac R-matrix modelling of Spin-Induced Asymmetry in the
Scattering of Polarized Electrons from Polarized Cesium Atoms,
S. Ait-Tahar, I. P. Grant and
P. H. Norrington, Phys. Rev.Lett., 79,
2955-8 (1997).
- CESD97 - A revised version to expand jj-coupled symmetry
functions into determinants, S. Fritzsche and
I. P. Grant, Comput. Phys. Commun.,
103, 277-286 (1997).
- Numerical computation of molecular integrals via optimized
(vectorized) FORTRAN code, T. C. Scott, M. B. Monagan,
I. P. Grant and V. R. Saunders, Nucl. Instr. and
Methods in Physics Research, A 389, 117-120
(1997).
1996
- Electron scattering by Fe XXII within the Dirac R-matrix
approach S. Ait-Tahar, I. P. Grant and
P. H. Norrington, Phys. Rev. A 54, 3984
- (1996).
- GRASP92: a package for large-scale relativistic atomic
structure calculations , F. A. Parpia, C. Froese Fischer and
I. P. Grant, Computer Phys. Commun.
94, 249 - 271 (1996).
- I. P. Grant, in Atomic, Molecular and
Optical Physics Reference Book, edited by G. W. F. Drake.
Chapter 22: Relativistic Atomic Structure, pp. 258 - 286 (American
Institute of Physics, New York, 1996.)
1995
- Relativistic configuration-interaction approach to the
elastic scattering of electrons from atoms, J. E. Sienkiewicz,
S. Fritzsche and I. P. Grant J. Phys. B:
At. Mol. Opt. Phys. 28, L633 - L636 (1995).
- A program for the expansion of jj-coupled
symmetry functions into Slater determinants, S. Fritzsche and
I. P. Grant , Comput. Phys. Commun.
92, 111 - 126 (1995).
- Correlations and level statistics in complex spectra
J. P. Connerade, I. P. Grant, P. Marketos and
J. Oberdisse, J. Phys. B: At. Mol. Opt. Phys.,
28, 2539 - 2551 (1995).
- R-matrix calculations of interactions of electrons with
ions, atoms and molecules, I. P. Grant,
in ``Review of Supercomputing 1991-1994'', Section 1 (EPSRC, 1995).
1994
- Relativistic calculation of atomic properties,
I. P. Grant, Comput. Phys. Commun.,
84 59-77 (1994).
- Ab initio calculation of the 2s2 1S0 - 2s3p 3 P1 intercombination transition in
beryllium like ions, S. Fritzsche and
I. P. Grant Physica Scripta,
50, 473-480 (1994).
- On the ab initio calculation of the
5S2o -
3PJe intercombination
transitions in P II: relativity and electron relaxation ,
S. Fritzsche and I. P. Grant,
Phys. Lett. A, 186, 152-156 (1994).
- Atomic self-energy calculations using partial-wave mass
renormalization, H. M. Quiney and
I. P. Grant, J. Phys. B:
At. Mol. Opt. Phys., 27, L299-304 (1994).
- Dirac-Fock calculations of X-ray scattering factors and
contributions to the mean inner potential for electron
scattering, D. Rez, P. Rez and I. P. Grant,
Acta Crystallographica, A, 50, 481-497
(1994).
- The Oxford electron-beam ion trap: A device for
spectroscopy of highly-charged ions, J. D. Silver,
A. J. Varney, H. S. Margolis, P. E. G. Baird,
I. P. Grant, P. D. Groves, W. A. Hallett,
A. T. Handford, P. J. Hirst, A. R. Holmes, D. J. H. Howie,
R. A. Hunt, K. Nobbs, M. Roberts, W. Studholme, M. T. Williams,
M. A. Levine, D. D. Dietrich, W. G. Graham, I. D. Williams,
R. O'Neil and S. J. Rose, Rev. Sci. Instrum.,
65(4), 1072-4 (1994).
- Relativistic electronic structure of atoms and molecules,
I. P. Grant, Adv. Atom. Molec. and
Opt. Phys., 32, 169-186 (1994).
1993
- Parameter-free renormalization in the self-mass correction
computation, V. L. Yakhontov and I. P. Grant,
J. Phys. B: At. Mol. Opt. Phys., 26,
L773-781 (1993).
- Partial wave mass renormalization in atomic QED
calculations, I. P. Grant and H. M. Quiney,
Physica Scripta T46, 132-138 (1993).
- A program for generating complete active spaces for
relativistic atomic structure calculations, F. A. Parpia,
W. P. Wijesundera and I. P. Grant,
Comput. Phys. Commun. 76, 127-139 (1993).
- A class of Bessel function integrals with application in
particle physics, I. P. Grant and
H. M. Quiney, J. Phys. A: Math. Gen. 26,
7547-7562 (1993).
1992
- The 6s2 6p3 resonances in
electron scattering by neutral Pb , W. P. Wijesundera,
I. P. Grant and P. H. Norrington J. Phys. B:
At. Mol. Opt. Phys. 25, 2165-2174 (1992).
- The 6s26p and 6s6p2
resonances in electron scattering by neutral Hg,
W. P. Wijesundera, I. P. Grant and
P. H. Norrington, J. Phys. B: At. Mol. Opt. Phys.
25, 2143-2163, 4363 Erratum, (1992).
- Relativistic electronic structure theory,
I. P. Grant in Methods in
Computational Molecular Physics, edited by S. Wilson and G. H. F.
Diercksen pp. 1-6 (Plenum, New York, 1992).