The international collaboration on Computation Atomic Structure

CompAS Publications

Authors Title Year Source title Volume Issue Art. No. Page start DOI
Saha B.; Fritzsche S. M1 and E2 transitions in Ar II 2005 Journal of Physics B: Atomic, Molecular and Optical Physics 38 8   1161 10.1088/0953-4075/38/8/007
Dong C.Z.; Fritzsche S. Relativistic, relaxation, and correlation effects in spectra of CuII 2005 Physical Review A - Atomic, Molecular, and Optical Physics 72 1 12507   10.1103/PhysRevA.72.012507
Radtke T.; Fritzsche S.; Surzhykov A. Control of entanglement following the photoionization of trapped, hydrogen-like ions 2005 Physics Letters, Section A: General, Atomic and Solid State Physics 347 1-3   73 10.1016/j.physleta.2005.06.106
Rosmej F.B.; Stamm R.; Fritzsche S. et al. Neutral helium line emission for edge plasma conditions 2005 Journal of Nuclear Materials 337-339 1-3 SPEC. ISS.   1101 10.1016/j.jnucmat.2004.10.141
Bieroń J. Multiconfiguration Dirac-Hartree-Fock calculations of the hyperfine structures of radium 2005 Journal of Physics B: Atomic, Molecular and Optical Physics 38 13   2221 10.1088/0953-4075/38/13/014
Corrégé G.; Hibbert A. The oscillator strengths of fe II λλ2507, 2509 2005 Astrophysical Journal 627 2 II   L157 10.1086/432643
Radtke T.; Fritzsche S. Simulation of n-qubit quantum systems. I. Quantum registers and quantum gates 2005 Computer Physics Communications 173 1-2   91 10.1016/j.cpc.2005.07.006
Toner A.; Hibbert A. Transitions in Mn II of astrophysical importance 2005 Monthly Notices of the Royal Astronomical Society 361 2   673 10.1111/j.1365-2966.2005.09218.x
Tayal S.S.; Zatsarinny O. B-spline R-matrix with pseudostates approach for electron impact excitation of atomic nitrogen 2005 Journal of Physics B: Atomic, Molecular and Optical Physics 38 20   3631 10.1088/0953-4075/38/20/001
Ursescu D.; Tomaselli M.; Kuehl T. et al. Symbolic algorithms for the computation of Moshinsky brackets and nuclear matrix elements 2005 Computer Physics Communications 173 3   140 10.1016/j.cpc.2004.09.012
Bieroń J.; Pyykkö P. Degree of accuracy in determining the nuclear electric quadrupole moment of radium 2005 Physical Review A - Atomic, Molecular, and Optical Physics 71 3 32502   10.1103/PhysRevA.71.032502
Fritzsche S.; Surzhykov A.; Sepp W.-D. et al. Algebraic tools for studying the properties and behaviour of hydrogen-like ions 2005 Nuclear Instruments and Methods in Physics Research, Section B: Beam Interactions with Materials and Atoms 235 1-4   140 10.1016/j.nimb.2005.03.161
Hibbert A. ‘Over-ambitious’ calculations revisited 2005 Physica Scripta T T120     71 10.1088/0031-8949/2005/T120/011
De Fanis A.; Prümper G.; Hergenhahn U. et al. Investigation of valence inter-multiplet Auger transitions in Ne following 1s photoelectron recapture 2005 Journal of Physics B: Atomic, Molecular and Optical Physics 38 13   2229 10.1088/0953-4075/38/13/015
Fischer C.F.; Tachiev G.; Irimia A. Theoretical transition probabilities and lifetimes 2005 Physica Scripta T T120     66 10.1088/0031-8949/2005/T120/010
Zatsarinny O.; Gorczyca T.W.; Korista K.T. et al. Erratum: Dielectronic recombination data for dynamic finite-density plasmas II. The oxygen isoelectronic sequence (Astronomy and Astrophysics (2003) 412 (587-595) DOI: 10.1051/0004-6361:20031462) 2005 Astronomy and Astrophysics 438 2   743 10.1051/0004-6361:20053312e
Scharf O.; Gaigalas G.; Fritzsche S. et al. Application of the Racah package for dealing with the expressions from the atomic shell model 2005 Nuclear Instruments and Methods in Physics Research, Section B: Beam Interactions with Materials and Atoms 235 1-4   135 10.1016/j.nimb.2005.03.160
Nikkinen J.; Aksela H.; Fritzsche S. et al. Photoionization and Auger decay of the 3d vacancy state of atomic strontium: Electron-electron correlations 2005 Physical Review A - Atomic, Molecular, and Optical Physics 72 4 42706   10.1103/PhysRevA.72.042706
Chandler C.; Bentley M.A.; Carpenter M.P. et al. First observation of excited states in the T = -1, odd-odd nucleus 48 Mn 2005 AIP Conference Proceedings 764     199 10.1063/1.1905311
Bacchus-Montabonel M.C.; Piechowska K.; Tergiman Y.S. et al. Photodissociation of polyatomic systems: Non-adiabatic effects and conical intersections 2005 Journal of Molecular Structure: THEOCHEM 729 1-2 SPEC. ISS.   115 10.1016/j.theochem.2005.03.055
Zatsarinny O.; Gorczyca T.W.; Korista K.T. et al. Erratum: Dielectronic recombination data for dynamic finite-density plasmas IV. The carbon isoelectronic sequence (Astronomy and Astrophysics (2004) 417 (1173-1181) 10.1051/0004-6361:20034174) 2005 Astronomy and Astrophysics 440 3   1203 10.1051/0004-6361:20034174e
Borovik A.A.; Grum-Grzhimailo A.N.; Bartschat K. et al. Electron impact excitation of the (3p54s2) 2P3/2,1/2 autoionizing states in potassium 2005 Journal of Physics B: Atomic, Molecular and Optical Physics 38 8   1081 10.1088/0953-4075/38/8/001
Surzhykov A.; Fritzsche S. Electron angular and energy distributions following the ionization of highly charged projectile ions 2005 Journal of Physics B: Atomic, Molecular and Optical Physics 38 15   2711 10.1088/0953-4075/38/15/011
Fritzsche S.; Surzhykov A.; Thomas St. Radiative recombination into high-Z few-electron ions: Cross sections and angular distributions 2005 Physical Review A - Atomic, Molecular, and Optical Physics 72 1 12704   10.1103/PhysRevA.72.012704
Penttilä A.; Heinäsmäki S.; Harkoma M. et al. Effects of electron correlation on the decay process following 3p photoionization in atomic manganese 2005 Physical Review A - Atomic, Molecular, and Optical Physics 71 2 22715   10.1103/PhysRevA.71.022715
Toner A.; Hibbert A. Oscillator strengths of transitions in Fe III 2005 Monthly Notices of the Royal Astronomical Society 364 2   683 10.1111/j.1365-2966.2005.09594.x
Huang M.; Andersson M.; Brage T. et al. Multiconfiguration Dirac-Hartree-Fock calculations for intercombination lines in silicon-like ions 2005 Journal of Physics B: Atomic, Molecular and Optical Physics 38 5   503 10.1088/0953-4075/38/5/003
Koval P.; Fritzsche S. Relativistic central-field Green’s functions for the Ratip package 2005 Computer Physics Communications 172 3   187 10.1016/j.cpc.2005.01.023
Surzhykov A.; Fritzsche S.; Sepp W.-D. et al. Polarization and alignment transfer in heavy hydrogen-like ions following radiative electron capture 2005 Nuclear Instruments and Methods in Physics Research, Section B: Beam Interactions with Materials and Atoms 235 1-4   276 10.1016/j.nimb.2005.03.189
Fischer C.F. Breit-Pauli lifetimes and transition probabilities for SiI 2005 Physical Review A - Atomic, Molecular, and Optical Physics 71 4 42506   10.1103/PhysRevA.71.042506
Zatsarinny O.; Bartschat K. Benchmark calculations for electron collisions with Fe+ 2005 Physical Review A - Atomic, Molecular, and Optical Physics 72 2 20702   10.1103/PhysRevA.72.020702
Fischer C.F. Relativistic calculations for highly charged ions 2005 Nuclear Instruments and Methods in Physics Research, Section B: Beam Interactions with Materials and Atoms 235 1-4   100 10.1016/j.nimb.2005.03.153
Hartman H.; Damineli A.; Johansson S. et al. Time variations of the narrow Fe II and H I spectral emission lines from the close vicinity of η Carinae during the spectral event of 2003 2005 Astronomy and Astrophysics 436 3   945 10.1051/0004-6361:20052835
Piechowska K.; Bacchus-Montabonel M.-C.; Tergiman Y.S. et al. Adiabatic potential energy surfaces of the vinoxy radical 2005 Proceedings of SPIE - The International Society for Optical Engineering 5849   43 239 10.1117/12.629521
Rykhlinskaya K.; Fritzsche S. Generation of molecular symmetry orbitals for the point and double groups 2005 Computer Physics Communications 171 2   119 10.1016/j.cpc.2005.03.112
Rudolph D.; Johansson E.K.; Andersson L.-L. et al. Exotic decay modes in rotating nuclei 2005 Nuclear Physics A 752 1-4 SPEC. ISS.   241 10.1016/j.nuclphysa.2005.02.083
Backe H.; Dretzke A.; Fritzsche St. et al. Laser spectroscopic investigation of the element fermium (Z = 100) 2005 Hyperfine Interactions 162 1-4   3 10.1007/s10751-005-9209-x
Zatsarinny O.; Bartschat K.; Bandurina L. et al. Electron-impact excitation of carbon 2005 Physical Review A - Atomic, Molecular, and Optical Physics 71 4 42702   10.1103/PhysRevA.71.042702
Da Pieve F.; Avaldi L.; Camilloni R. et al. Study of electronic correlations in the Auger cascade decay from Ne*1s-13p 2005 Journal of Physics B: Atomic, Molecular and Optical Physics 38 19   3619 10.1088/0953-4075/38/19/014
Fritzsche S.; Indelicato P.; Stöhlker Th. Relativistic quantum dynamics in strong fields: Photon emission from heavy, few-electron ions 2005 Journal of Physics B: Atomic, Molecular and Optical Physics 38 9   S707 10.1088/0953-4075/38/9/018
Gaigalas G.; Scharf O.; Fritzsche S. Maple procedures for the coupling of angular momenta. VIII. Spin-angular coefficients for single-shell configurations 2005 Computer Physics Communications 166 2   141 10.1016/j.cpc.2004.11.003
Blackwell-Whitehead R.J.; Toner A.; Hibbert A. et al. Hyperfine structure of the ground state in singly ionized manganese 2005 Monthly Notices of the Royal Astronomical Society 364 2   705 10.1111/j.1365-2966.2005.09597.x
Johansson S.; Gull T.R.; Hartman H. et al. Metastable hydrogen absorption in ejecta close to η Carinae 2005 Astronomy and Astrophysics 435 1   183 10.1051/0004-6361:20041193
Mach H.; Walker P.M.; Julin R. et al. Application of ultra-fast timing techniques to the study of exotic and weakly produced nuclei 2005 Journal of Physics G: Nuclear and Particle Physics 31 10   S1421 10.1088/0954-3899/31/10/007
Surzhykov A.; Fritzsche S.; Stöhlker T. et al. Application of radiative electron capture for the diagnostics of spin-polarized ion beams at storage rings 2005 Physical Review Letters 94 20 203202   10.1103/PhysRevLett.94.203202
Žalandauskas T.; Gaigalas G.; Rudzikas Z. Optimization of coupling scheme in 2pN3l (N = 2, 3, 4 and l = s, p, d) isoelectronic sequences 2005 Nuclear Instruments and Methods in Physics Research, Section B: Beam Interactions with Materials and Atoms 235 1-4   149 10.1016/j.nimb.2005.03.163
Jasik P.; Sienkiewicz J.E. Adiabatic potential energy curves of Li2 2005 Proceedings of SPIE - The International Society for Optical Engineering 5849   11 82 10.1117/12.629466
Yoshida H.; Sasaki J.; Kawabe Y. et al. Study of second-step Auger transitions in Auger cascades following 1s → 3p photoexcitation in Ne 2005 Journal of Physics B: Atomic, Molecular and Optical Physics 38 5   465 10.1088/0953-4075/38/5/001
Zhou H.-L.; Manson S.T.; Hibbert A. et al. Photodetachment of the outer shell of C- in the excited D2 state 2005 Physical Review A - Atomic, Molecular, and Optical Physics 72 3 32723   10.1103/PhysRevA.72.032723
Járai-Szabó F.; Nagy L.; Fritzsche S. Correlation effects for double K-shell vacancy production in lithium by fast charged projectile impact 2005 Nuclear Instruments and Methods in Physics Research, Section B: Beam Interactions with Materials and Atoms 233 1-4   276 10.1016/j.nimb.2005.03.121
Audzijonis A.; Gaigalas G.; Žigas L. et al. Splitting of the XPS in ferroelectric SbSBr crystals 2005 Ferroelectrics, Letters Section 32 5-6   111 10.1080/07315170500416587
Palmeri P.; Fischer C.F.; Wyart J.-F. et al. Oscillator strength calculations in neutral technetium 2005 Monthly Notices of the Royal Astronomical Society 363 2   452 10.1111/j.1365-2966.2005.09410.x
McLaughlin B.M.; Hibbert A.; Scott M.P. et al. Electron impact excitation of Fe-peak elements: Forbidden transitions in the 3d5 manifold of Fe IV 2005 Journal of Physics B: Atomic, Molecular and Optical Physics 38 12   2029 10.1088/0953-4075/38/12/016
Ekman J.; Andersson L.-L.; Fahlander C. et al. News on mirror nuclei in the sd and fp shells 2005 European Physical Journal A 25 SUPPL. 1   363 10.1140/epjad/i2005-06-016-2
Syty P.; Sienkiewicz J.E. Relativistic multiconfiguration method in low-energy scattering of electrons from argon atoms 2005 Journal of Physics B: Atomic, Molecular and Optical Physics 38 16   2859 10.1088/0953-4075/38/16/001
Ricz S.; Nikkinen J.; Sankari R. et al. Interference effects in the angular distribution of Ar3p photoelectrons across the 2p ns md resonances 2005 Physical Review A - Atomic, Molecular, and Optical Physics 72 1 14701   10.1103/PhysRevA.72.014701
Grum-Grzhimailo A.N.; Fritzsche S.; O’Keeffe P. et al. Universal scaling of resonances in vector correlation photoionization parameters 2005 Journal of Physics B: Atomic, Molecular and Optical Physics 38 14   2545 10.1088/0953-4075/38/14/017
Bacchus-Montabonel M.C.; Łabuda M.; Tergiman Y.S. et al. Theoretical treatment of charge-transfer processes induced by collision of Cq+ ions with uracil 2005 Physical Review A - Atomic, Molecular, and Optical Physics 72 5 52706   10.1103/PhysRevA.72.052706
Hartman H.; Schef P.; Lundin P. et al. The Ferrum project: Experimentally determined metastable lifetimes and transition probabilities for forbidden [Ti II] lines observed in η Carinae 2005 Monthly Notices of the Royal Astronomical Society 361 1   206 10.1111/j.1365-2966.2005.09157.x
Ekman J.; Fahlander C.; Rudolph D. Mirror symmetry in the upper fp shell 2005 Modern Physics Letters A 20 39   2977 10.1142/S0217732305019018
Bömmels J.; Franz K.; Hoffmann T.H. et al. Low-lying resonances in electron-neon scattering: Measurements at 4-meV resolution and comparison with theory 2005 Physical Review A - Atomic, Molecular, and Optical Physics 71 1 12704   10.1103/PhysRevA.71.012704
Hibbert A.; Corrégé G. Transitions in Fe II 2005 Physica Scripta T T119     61 10.1088/0031-8949/2005/t119/011
Surzhykov A.; Koval P.; Fritzsche S. Angular correlations in the two-photon decay of hydrogenlike ions: Relativistic Green’s-function approach 2005 Physical Review A - Atomic, Molecular, and Optical Physics 71 2 22509   10.1103/PhysRevA.71.022509
Hartman H.; Johansson S.; Lundberg H. et al. Experimental oscillator strengths for forbidden lines in complex spectra 2005 Physica Scripta T T119     40 10.1088/0031-8949/2005/t119/007
Bieroń J.; Pyykkö P.; Jönsson P. Nuclear quadrupole moment of 201Hg 2005 Physical Review A - Atomic, Molecular, and Optical Physics 71 1 12502   10.1103/PhysRevA.71.012502
Irimia A.; Fischer C.F. Breit-Pauli oscillator strengths, lifetimes and Einstein A-coefficients in singly ionized sulphur 2005 Physica Scripta 71 2   172 10.1238/Physica.Regular.071a00172
Du Rietz R.; Williams S.J.; Rudolph D. et al. Investigation of high-spin states in Fe53 2005 Physical Review C - Nuclear Physics 72 1 14307   10.1103/PhysRevC.72.014307
Fritzsche S. On the accuracy of valence-shell computations for heavy and super-heavy elements 2005 European Physical Journal D 33 1   15 10.1140/epjd/e2005-00013-1
Uvarov A.; Fritzsche S. A semi-phenomenological approach to the transport and diffusion of small spherical macromolecules in solution 2005 Chemical Physics Letters 401 1-3   296 10.1016/j.cplett.2004.11.062
Audzijonis A.; Gaigalas G.; Žigas L. et al. Theoretical investigation of the electronic structure of a ferroelectric SbSI cluster at a phase transition 2005 Central European Journal of Physics 3 3   382 10.2478/bf02475645
McElroy T.; Hibbert A. Lifetimes of the 4s4p1,3P1o levels in Ga II 2005 Physica Scripta 71 5   479 10.1238/Physica.Regular.071a00479
Nagy L.; Járai-Szabó F.; Fritzsche S. Ionization-excitation of lithium by fast charged projectiles 2005 Journal of Physics B: Atomic, Molecular and Optical Physics 38 3   141 10.1088/0953-4075/38/3/001
Andersson L.-L.; Johansson E.K.; Ekman J. et al. Identification of excited states in 3161Ga 30: Mirror nuclei in the upper f p shell 2005 Physical Review C - Nuclear Physics 71 1 11303   10.1103/PhysRevC.71.011303
Zatsarinny O.; Bartschat K. Benchmark calculations for electron collisions with zinc atoms 2005 Physical Review A - Atomic, Molecular, and Optical Physics 71 2 22716   10.1103/PhysRevA.71.022716
Surzhykov A.; Koval P.; Fritzsche S. Algebraic tools for dealing with the atomic shell model. I. Wavefunctions and integrals for hydrogen-like ions 2005 Computer Physics Communications 165 2   139 10.1016/j.cpc.2004.09.004