Charlotte Froese Fischer
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Canadian-American applied mathematician and computer scientist
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Why Is Charlotte Froese Fischer Influential?
(Suggest an Edit or Addition)According to Wikipedia, Charlotte Froese Fischer is a Canadian-American applied mathematician and computer scientist noted for the development and implementation of the Multi-Configurational Hartree–Fock approach to atomic-structure calculations and its application to the description of atomic structure and spectra.
Charlotte Froese Fischer's Published Works
Published Works
- GRASP92: a package for large-scale relativistic atomic structure calculations (1996) (562)
- The grasp2K relativistic atomic structure package (2007) (472)
- New version: Grasp2K relativistic atomic structure package (2013) (432)
- Computational Atomic Structure: An MCHF Approach (1997) (355)
- The Hartree-Fock method for atoms: A numerical approach (1977) (316)
- Breit–Pauli energy levels, lifetimes, and transition probabilities for the beryllium-like to neon-like sequences☆ (2004) (258)
- Average-energy-of-configuration Hartree-Fock results for the atoms helium to radon charlotte froese fischer (1972) (241)
- General Hartree-Fock program (1987) (232)
- NUMERICAL SOLUTION OF THE HARTREE–FOCK EQUATIONS (1963) (194)
- Relativistic energy levels, lifetimes, and transition probabilities for the sodium-like to argon-like sequences (2006) (189)
- GRASP2018 - A Fortran 95 version of the General Relativistic Atomic Structure Package (2019) (162)
- A general multi-configuration Hartree-Fock program (1984) (137)
- A Davidson program for finding a few selected extreme eigenpairs of a large, sparse, real, symmetric matrix (1994) (132)
- A multi-configuration Hartree-Fock program (1984) (127)
- An MCHF atomic-structure package for large-scale calculations (2007) (123)
- A general program for computing angular integrals of the Breit-Pauli Hamiltonian (1991) (118)
- A multi-configuration Hartree-Fock program with improved stability (1984) (114)
- Hartree—Fock Parameters for the Atoms Helium to Radon (1966) (109)
- Properties of Some Tridiagonal Matrices and Their Application to Boundary Value Problems (1969) (108)
- The MCHF atomic-structure package (2000) (100)
- Multiconfiguration Hartree-Fock results with Breit-Pauli corrections for forbidden transitions in the2p4configuration (1983) (100)
- Average-energy-of-configuration Hartree-Fock results for the atoms helium to radon (1973) (90)
- HFS92: A program for relativistic atomic hyperfine structure calculations (1996) (89)
- The use of basis splines and non-orthogonal orbitals in R-matrix calculations: application to Li photoionization (2000) (88)
- An efficient approach for spin - angular integrations in atomic structure calculations (1997) (87)
- Breit-Pauli energy levels and transition rates for nitrogen-like and oxygen-like sequences (2002) (85)
- Multiconfiguration Hartree-Fock Results with Breit-Pauli Corrections for Transitions in the Carbon Sequence (1985) (77)
- Spline algorithms for continuum functions (1989) (71)
- Oscillator strengths for 2S-2P transitions in the copper sequence (1977) (71)
- Breit-Pauli energy levels, lifetimes, and transition data: beryllium-like spectra (1999) (70)
- JJ2LSJ Transformation and Unique Labeling for Energy Levels (2017) (68)
- RELCI: A program for relativistic configuration interaction calculations ? ? This program can be dow (2002) (68)
- Z-dependence of correlation effects and f values in the sodium iso-electronic sequence (1976) (67)
- Computational Atomic Structure (2019) (66)
- JJGEN: A flexible program for generating lists of jj-coupled configuration state functions (2007) (63)
- REOS99: A revised program for transition probability calculations including relativistic, correlation, and relaxation effects (2000) (60)
- Hyperfine Induced Transitions as Diagnostics of Isotopic Composition and Densities of Low-Density Plasmas (1998) (58)
- Spline methods for resonances in photoionisation cross sections (1990) (57)
- Extension of the HF program to partially filled f-subshells (1996) (57)
- Programs for computing LS and LSJ transitions from MCHF wave functions (1991) (56)
- Theoretical Oscillator Strengths for nP → nD Transitions in Mg (1975) (55)
- Some Hartree—Fock Results for Two‐ and Four‐Electron Atomic Systems (1967) (55)
- Evaluating the accuracy of theoretical transition data (2009) (55)
- MCHF-BP fine-structure splittings and transition rates for the ground configuration in the nitrogen sequence (1984) (54)
- The self-consistent field with exchange for some 10 and 12 electron systems (1957) (54)
- Non-relativistic variational calculations of atomic properties in Li-like ions: Li I to O VI (2001) (53)
- Allowed transitions and intercombination lines in C III and C II (1994) (53)
- Robust preconditioning of large, sparse, symmetric eigenvalue problems (1995) (53)
- A program for performing angular integrations for transition operators (1991) (53)
- Collapse of the 4f orbital for Xe-like ions (1983) (51)
- A general program for computing angular integrals of the Breit-Pauli Hamiltonian with non-orthogonal orbitals (2000) (51)
- Theoretical oscillator strengths for the resonance transitions in the Zn I isoelectronic sequence (1978) (51)
- ACCURATE MULTICONFIGURATION DIRAC-FOCK CALCULATIONS OF TRANSITION PROBABILITIES IN THE MG ISOELECTRONIC SEQUENCE (1997) (51)
- The solution of Schrödinger's equation for two-electron systems by an MCHF procedure (1973) (49)
- Multiconfiguration Hartree-Fock Breit-Pauli results for 2P1/2-2P3/2 transitions in the boron sequence (1983) (48)
- Lifetime trends for the n=3 singlet states in the Mg sequence☆ (1982) (47)
- Convergence studies of MCHF calculations for Be and Li (1993) (47)
- Systematic calculations of correlation in complex ions (1993) (47)
- Energy levels, lifetimes, wavelengths, and transition probabilities of Fe XIV (1986) (44)
- Energies and E1, M1, E2, M2 transition rates for states of the 2s22p, 2s2p2, and 2p3 configurations in boron-like ions between N III and Zn XXVI (2012) (43)
- On the status and perspectives of MCDF calculations and measurements of transition data in the Be isoelectronic sequence (1998) (43)
- Oscillator strengths for transitions to high-lying excited states of carbon (2002) (42)
- Spline algorithms for the Hartree-Fock equation for the helium ground state (1990) (41)
- Lifetimes of Low-Lying 2P0, 2D, and 2F0 States of the A1 I Isoelectronic Sequence (1981) (40)
- Convergence studies of atomic properties from variational methods (1993) (40)
- MCHF calculations of isotope shifts and oscillator strengths for transitions between low-lying states in Be-like systems and neutral magnesium (1999) (40)
- Non-variational, spline-Galerkin calculations of resonance positions and widths, and photodetachment and photo-ionization cross sections for H- and He (1992) (39)
- Relativistic CI calculations of spectroscopic data for the 2p6 and 2p53l configurations in Ne-like ions between Mg III and Kr XXVII (2014) (38)
- Configuration maxing in the Al sequence (1968) (38)
- Resonance transition energies and oscillator strengths in lutetium and lawrencium. (2002) (37)
- Multiconfiguration Dirac-Hartree-Fock calculations of the forbidden transitions between 3s2 1S0,3s3p 3P0,1,2,1P1 states for Mg-like ions (2001) (36)
- A B-spline Galerkin method for the Dirac equation (2008) (36)
- Oscillator strengths for the 2P–2D transitions of the Al I sequence (1976) (36)
- MULTICONFIGURATION DIRAC-FOCK CALCULATIONS OF THE 2S21S0-2S2P 3P1 INTERCOMBINATION TRANSITION IN C III (1998) (36)
- BREIT–PAULI ENERGIES, TRANSITION PROBABILITIES, AND LIFETIMES FOR 2s, 2p, 3s, 3p, 3d, 4s2LLEVELS OF THE LITHIUM SEQUENCE,Z= 3–8 (1998) (35)
- Systematic studies of N IV transitions of astrophysical importance (1995) (35)
- Spline methods for multiconfiguration Hartree–Fock calculations (1992) (35)
- Isotope shift in the sulfur electron affinity: Observation and theory (2010) (34)
- Accurate oscillator strengths (1988) (34)
- A general program for computing angular integrals of the non-relativistic Hamiltonian with non-orthogonal orbitals (1991) (34)
- Breit-Pauli energy levels and transition rates for the carbonlike sequence (2001) (34)
- Self-consistent-field (SCF) and multiconfiguration (MC) Hartree-Fock (HF) methods in atomic calculations: Numerical integration approaches (1986) (33)
- Discrepancies between theoretical and experimental atomic oscillator strengths of the sodium isoelectronic sequence resonance transition (1976) (33)
- A program for computing magnetic dipole and electric quadrupole hyperfine constants from MCHF wavefunctions (1993) (33)
- Multiconfiguration Dirac-Hartree-Fock Calculations with Spectroscopic Accuracy: Applications to Astrophysics (2017) (33)
- REDUCED COEFFICIENTS (SUBCOEFFICIENTS) OF FRACTIONAL PARENTAGE FORp-,d-, ANDf-SHELLS (1998) (32)
- REOS — A program for relaxed-orbital oscillator strength calculations (1997) (31)
- The differential analyzer (2003) (30)
- Core-polarization effects in the Cadmium isoelectronic sequence (2000) (30)
- Hartree-Fock Procedure for Some nsn's 1 S Configurations (1966) (30)
- DBSR_HF: A B-spline Dirac-Hartree-Fock program (2016) (29)
- Calculations with spectroscopic accuracy: Energies, transition rates,and Lande gJ-factors in the carbon isoelectronic sequence from Ar XIII to Zn XXV (2014) (29)
- Atomic structure calculations using MCHF and BSR (2009) (28)
- CALCULATED LEVEL ENERGIES, TRANSITION PROBABILITIES, AND LIFETIMES FOR PHOSPHORUS-LIKE IONS OF THE IRON GROUP IN THE 3s3p4AND 3s23p23dCONFIGURATIONS☆ (1998) (28)
- The Effect of Configuration Interaction on the Transition Integral. (1965) (27)
- Accurate spline solutions of the radial Dirac equation (1993) (27)
- MCHF CALCULATIONS FOR ATOMIC PROPERTIES (1994) (27)
- Comparison of multichannel-quantum-defect theory and multiconfiguration-Hartree-Fock wave-functions for alkaline-earth atoms (1981) (27)
- Short-range interactions involving plunging configurations of the n = 3 singlet complex in the Mg sequence (1982) (26)
- Landé g factors for 2p4 (3P)3p and 2p4(3P)3d states of Ne II (2001) (26)
- Photon Emission from Core-Excited Be I and Be II States (1983) (25)
- Energies and E1, M1, E2, and M2 transition rates for states of the 2s{sup 2}2p{sup 3}, 2s2p{sup 4}, and 2p{sup 5} configurations in nitrogen-like ions between F III and Kr XXX (2014) (24)
- Core polarization in Ca I and Ca II (1993) (24)
- Numerical solution of general Hartree-Fock equations for atoms (1978) (24)
- Complete Active Space multiconfiguration Dirac-Hartree-Fock calculations of hyperfine structure constants (2009) (24)
- SUPERPOSITION OF CONFIGURATION RESULTS FOR Si II. (1968) (24)
- Effects of electron correlation, relativity, and nuclear structure on hyperfine constants of Be{sup +} and F{sup 6+} (1999) (23)
- A partitioned correlation function interaction approach for describing electron correlation in atoms (2013) (23)
- MCHF evaluation of the specific mass shift (1983) (23)
- Regular Article: Integration by Cell Algorithm for Slater Integrals in a Spline Basis (1999) (23)
- Evaluation and Comparison of the Configuration Interaction Calculations for Complex Atoms (2014) (23)
- LETTER TO THE EDITOR: Lifetime and hyperfine structure of the 3D2 state of radium (2004) (23)
- Transition rates for some forbidden lines in Fe IV (1998) (22)
- Accurate Multiconfiguration Hartree-fock Calculations of Oscillator-strengths In Light-atoms - the Boron (b-ii) Line At 1362 Angstrom (1995) (22)
- Some improved transition probabilities for neutral carbon (2006) (22)
- Accurate calculations of transition probabilities, isotope shifts and hyperfine structures for some allowed ? - ? transitions in B I, C II and C I (1996) (22)
- MCHF calculations for 1S and 1P Rydberg states in Ca I (1985) (22)
- Atomic Structure Variational Calculations in Spectroscopy (1998) (22)
- Large-scale MCHF calculations of hyperfine structures in nitrogen and oxygen (1997) (21)
- MCHF atomic-structure package: support libraries and utilities (1991) (21)
- Systematic transition probability studies for neutral nitrogen (1994) (21)
- Numerical Hartree–Fock results for the atoms helium to radon (1968) (21)
- Energy levels and lifetimes for some quartet states of Be II (1982) (21)
- Photodetachment cross section of He − ( 1 s 2 s 2 p 4 P o ) in the region of the 1 s detachment threshold (1999) (21)
- Exploring biorthonormal transformations of pair-correlation functions in atomic structure variational calculations (2009) (21)
- Transition Probabilities for the UV0.01 Multiplet in N III (1995) (20)
- Brillouin's theorem for excited (nl)q(n'l)q' configurations (1973) (20)
- Isotope shift in the oxygen electron affinity (1999) (20)
- MCDHF and RCI calculations of energy levels, lifetimes and transition rates for 3l3l ', 3l4l ', and 3s5l states in Ca IX - As XXII and Kr XXV (2017) (20)
- A configuration interaction program (1991) (20)
- Correlation effects important for accurate oscillator strengths (1974) (20)
- The 4s2S–4p2P transition of the Al sequence (1978) (20)
- A B-spline Hartree-Fock program (2011) (19)
- Atomic Structure: Multiconfiguration Hartree-Fock Theories (2006) (19)
- Towards accurate transition data for 3p2, 3p3, 3p4 levels of Fe, Co and Ni ions (2010) (19)
- Photodetachment of He− 1s2s2p 4Po in the region of the 1s threshold (2002) (19)
- Douglas Rayner Hartree : His life in science and computing (2003) (19)
- Some Multiplet Strengths for Transitions in fe XVI and fe XV. (1964) (19)
- Multiconfiguration Hartree-Fock calculations atomic properties for light atoms (1996) (19)
- Multi-Configuration Hartree–Fock Correlation Study of 1s2s1S (1973) (19)
- Multi-configuration Hartree-Fock calculations and time-resolved laser spectroscopy studies of hyperfine structure constants in sodium (1992) (18)
- A COMPARISON OF SPIN-ORBIT PARAMETERS (1967) (18)
- Oscillator-strength trends in the presence of level crossings (1980) (18)
- Multiconfiguration Dirac–Hartree–Fock energy levels and transition probabilities for 3d5 in Fe iv (2008) (18)
- Oscillator strengths for some D -F transitions in the Mg sequence (1979) (18)
- Comment on "Theoretical Confirmation of the Low Experimental 3C/3D f-Value Ratio in Fe xvii". (2017) (18)
- THE ORTHOGONALITY ASSUMPTION IN THE HARTREE–FOCK APPROXIMATION (1967) (18)
- Ab initio calculations for intercombination and resonance lines in P II (1993) (18)
- Non-orthogonal orbitals in MCHF or configuration interaction wave functions (1988) (17)
- Energy levels and transition rates for the boron isoelectronic sequence: Si X, Ti XVIII - Cu XXV , (2013) (17)
- Reflection of a transient electromagnetic wave at a conducting surface (1955) (17)
- Measurements and predictions of the 6s6p 1,3 P 1 lifetimes in the Hg isoelectronic sequence (2001) (17)
- Allowed transitions and intercombination lines in B II (1995) (17)
- Hartree-Fock Results for Some Excited States of O +2 , O + , and Ne + (1965) (17)
- Breit–Pauli and Dirac–Hartree–Fock energy levels and transition probabilities in neutral argon (2004) (17)
- Multiconfiguration Dirac-Hartree-Fock energy levels and transition probabilities for W xxxviii (2012) (16)
- Low-lying /sup 1/D states of Be I (1984) (16)
- The Effect of Correlation in the 3dn Core on the Resonance Transition in Cu II (1980) (16)
- Spline–Galerkin calculations for Rydberg series of calcium (1994) (16)
- A program to generate configuration-state lists (1991) (16)
- Note on the 2s2 1S0-2s2p 3P1 intercombination line of B II and C III (1997) (16)
- Accurate Calculation of the Isotope Shift and Hyperfine Structure in the Boron (B ii) Line at 1362 Angstrom (1994) (16)
- Relativistic and Correlation Effects on the Lifetimes of 3s4p 3PJo Levels in Mg-like Sulphur and Chlorine (1985) (16)
- Core Effects on Transition Energies for 3dk Configurations in Tungsten Ions (2017) (16)
- Laser transition probabilities in Xe I (2006) (15)
- Reducing synchronization on the parallel Davidson method for the large, sparse, eigenvalue problem (1993) (15)
- Systematic studies of the - transition in the Be-like sequence (1997) (15)
- B-splines in variational atomic structure calculations (2008) (15)
- Nuclear quadrupole moment of scandium (1997) (15)
- Iterative solution of the Hartree-Fock equations with improved stability (1972) (15)
- Ab initio MCDHF calculations of electron–nucleus interactions (2015) (15)
- Core polarization effects on oscillator strengths in neutral zinc (1992) (15)
- Transition probabilities in O III (1994) (15)
- MCHF+BP results for electric dipole transitions in the oxygen isoelectronic sequence (1984) (14)
- The 2p-3s transitions in atomic oxygen (1987) (14)
- Accurate multiconfiguration calculations of energy levels, lifetimes, and transition rates for the silicon isoelectronic sequence - Ti IX – Ge XIX, Sr XXV, Zr XXVII, Mo XXIX (2016) (14)
- Experimental and theoretical investigation of radiative lifetimes in neutral gallium (1986) (14)
- Breit and QED effects on the 3d9D3/22→2D5/2 transition energy in Co-like ions (2018) (14)
- Allowed and spin-forbidden electric dipole transitions in Ca I (2003) (14)
- Oscillator strength calculations in neutral technetium (2005) (14)
- LARGE-SCALE MULTICONFIGURATIONAL DIRAC-FOCK CALCULATIONS OF THE HYPERFINE-STRUCTURE CONSTANTS AND DETERMINATION OF THE NUCLEAR QUADRUPOLE MOMENT OF 49 TI (1999) (14)
- Combining Multiconfiguration and Perturbation Methods: Perturbative Estimates of Core–Core Electron Correlation Contributions to Excitation Energies in Mg-Like Iron (2017) (14)
- MULTICONFIGURATION DIRAC-FOCK CALCULATIONS OF THE HYPERFINE STRUCTURE CONSTANTS AND DETERMINATION OF THE NUCLEAR QUADRUPOLE MOMENT OF YTTRIUM 90 (1998) (14)
- Accurate multiconfiguration Hartree-Fock calculations of isotope shifts in C I and C IV (1995) (14)
- Multiconfiguration Dirac-Hartree-Fock optimization strategies for 3 s 2 1 S 0 − 3 s 3 p 3 P 1 transition rates for Al + − S 4 + (2000) (14)
- Comment on the magnetic dipole hyperfine interaction in the gold atom ground state (2008) (14)
- Excited states of the negative nitrogen ion: Energies and Lifetimes (1997) (14)
- A Pvm Implementation of the Mchf Atomic Structure Package (1996) (13)
- Transition energies and transition rates for the 2p4(3P)3p - 2p4(3P)3d transitions in Ne II (1999) (13)
- Oscillator strengths for 3dn4s → 3dn4p transitions in the iron series (1973) (13)
- Ab initio results for V I and Cr I (1976) (13)
- Numerical multiconfiguration Hartree-Fock calculations for nsnp3P states of Rb and Cs negative ions (1989) (13)
- Concurrent Vector Algorithms for Spline Solutions of the Helium Pair Equation (1991) (13)
- Breit–Pauli Oscillator Strengths, Lifetimes and Einstein A Coefficients in Singly Ionized Sulphur (2005) (12)
- Energies and E1, M1, E2, and M2 transition rates for states of the 2s22p4, 2s2p5, and 2p6 configurations in oxygen-like ions between F II and Kr XXIX (2013) (12)
- The - resonance line in neutral beryllium (1996) (12)
- A new version of AAKF (Reduced Tensor Matrix Elements) adapted to spectroscopic notation (1975) (12)
- A program to compute isotope shifts in atomic spectra (1993) (12)
- Breit–Pauli energy levels, transition probabilities and lifetimes for 3d5 levels in Fe iv of astrophysical interest (2004) (12)
- Hartree-Fock Calculations for Atoms with Inner-Shell Vacancies (1977) (12)
- Photoionization of magnesium (1987) (12)
- LSGEN - a program to generate configuration-state lists of LS-coupled basis functions (1993) (12)
- Electron affinities of At and its homologous elements Cl, Br, and I (2018) (12)
- Predictive data-based exposition of 5s5p{sup 1,3}P{sub 1} lifetimes in the Cd isoelectronic sequence (2000) (11)
- Doublet-quartet energy separation in boron: A partitioned-correlation-function-interaction method (2013) (11)
- MCHF calculations of autoionization widths in two- and three-electron systems (1993) (11)
- Measurement of the Kr XVIII 3d 2D5/2 lifetime in a unitary Penning Trap (2014) (11)
- Correlation study of Be 1 s 2 2 s 2 p P 1 by a separated-pair numerical multiconfiguration Hartree-Fock procedure (1974) (11)
- Lifetimes of 4 p 5 4 d levels in highly ionized atoms (2015) (11)
- 4 s 4 d D 1 − 4 p 2 D 1 interaction in the Zn I isoelectronic sequence (1979) (10)
- Superposition of configuration results for oxygen (1967) (10)
- Some Hartree–Fock Results for (3d + 4s)q+1 Configurations (1971) (10)
- The Mg+ 3s 2S1/2-4p 2Po3/2,1/2 weak transition probabilities revisited (1999) (10)
- Multi-configuration Hartree-Fock plus Breit-Pauli results for some forbidden transitions (1986) (10)
- Hyperfine-structure calculations of excited levels in neutral scandium (2002) (10)
- The deffered difference correction for the Numerov method (1971) (10)
- Nuclear magnetic shielding constants calculated from numerical hartree‐fock wave functions (2009) (10)
- Note on MCDF correlation calculations for high-Z ions (1994) (10)
- Correlation and Relativistic Effects on Transitions in Lighter Atoms (1999) (10)
- Spin-other-orbit Operator in the Tensorial Form of Second Quantization (1998) (9)
- The orthogonality assumption in the Hartree–Fock approximation for 2pn3p configurations (1968) (9)
- Optical quenching of metastable magnesium (2007) (9)
- Correlation effects on transition probabilities in Mo vi (2011) (9)
- A correlation study of Li ground state by the MCHF procedure (1975) (9)
- Correlation in negative ions (1989) (8)
- Autodetachment of the nsnp2 4P1/2 states in negative ions (1992) (8)
- Breit-Pauli lifetimes and transition probabilities for Si I (7 pages) (2005) (8)
- Contributions to the electron affinity of calcium and scandium (1992) (8)
- Multitasking the Davidson Algorithm for the Large, Sparse Eigenvalue Problem (1989) (8)
- Gƒ-VALUES for Lines of the SI II Spectrum (1966) (8)
- LIMITING SCREENING NUMBERS AND ENERGY PARAMETERS (1963) (7)
- Multiconfiguration Hartree-Fock calculations of the oscillator strength for the 2s2p /sup 1/P/sup 0/. -->. 2p/sup 2/,2snd /sup 1/D (n = 3--6) transitions in beryllium (1987) (7)
- ANALYSIS OF BREIT–PAULI TRANSITION PROBABILITIES FOR LINES IN O iii (2009) (7)
- PROGRAMS FOR ATOMIC-STRUCTURE CALCULATIONS. (1968) (7)
- A critical review of programs in atomic structure for bound states (1973) (7)
- Correlation and the 5F–3F energy separation in Ti (1982) (7)
- Oscillator Strengths for the 3s^{2}3p ^{2}P-3s3p^{2} ^{2}S Transition in AL I. (1965) (7)
- A Programming Language, by Kenneth E. Iverson. John Wiley and Sons, Inc., 1962. (1964) (7)
- 4p2 resonances in photoionization from 4s4p levels in neutral zinc (2007) (7)
- Radiative lifetime of a bound excited state of Te-. (2004) (7)
- Asymptotic Behaviour Of The Inverse Of a Laplace Transform (1955) (6)
- Oscillator strengths from numerical MCHF radial functions (1984) (6)
- Core-excited quintet states in Mg I (1991) (6)
- LETTER TO THE EDITOR: Magnetic-dipole transitions between the lowest 3d4 J = 2-3 transitions in highly charged titanium-like ions (2001) (6)
- Numerical Procedures for Relativistic Atomic Structure Calculations (2020) (6)
- Hypercube conversion of serial codes for atomic structure calculations (1992) (6)
- A distributed-memory implementation of the MCHF atomic structure package (1994) (6)
- Exact evaluation of slater integrals using ALTRAN, a symbol manipulation language (1973) (6)
- Cross section and angular distribution for the photodetachment of (12s2P) (1999) (6)
- Some corrections to GRASP92 (2006) (6)
- Correlation Effects and f-Values in the Sodium Sequence (1976) (6)
- Multiconfiguration Dirac–Hartree–Fock Calculations for Be-like Intercombination Lines Revisited (2000) (6)
- Reminiscences at the end of the Century (2000) (6)
- A comparison of multi-configuration Hartree-Fock and configuration interaction results for the 1D series of Mg (1970) (6)
- The Landé g-factor in atomic spectroscopy (2004) (6)
- Hartree-Fock Parameters for the 2p^{2} C i Sequence (1966) (6)
- The limiting behaviour of atomic wave functions for large atomic number (1957) (6)
- Multitasking the calculation of angular integrals on the CRAY-2 and CRAY X-MP (1988) (5)
- Theoretical Energy Levels of 3F0 Rydberg Series for Mg I, Al II, and Si III (1980) (5)
- The - intercombination line in the Be-like sequence (1997) (5)
- The effect of electron correlation on the charge density at the iron nucleus (1976) (5)
- The limiting behaviour of atomic wave functions for large atomic number. II (1958) (5)
- The electron affinity of in boron (1996) (5)
- Term dependence of Hartree-Fock results for some nln'l configurations (1972) (5)
- Relativistic all-order and multiconfiguration Hartree-Fock calculations of the 4d-4f energy separation in Li I (2007) (5)
- SOME TWO-ELECTRON PROPERTIES OF SODIUM (1998) (5)
- Natural orbitals in multiconfiguration calculations of hyperfine-structure parameters (2020) (5)
- Transition probability of the 1S0 → 1D2 emission of atomic oxygen (1982) (5)
- ANGULAR INTEGRATION USING SYMBOLIC STATE EXPANSIONS (2004) (4)
- CALCULATED DIFFRACTION PATTERNS OF DIELECTRIC RODS AT CENTIMETRIC WAVELENGTHS (1954) (4)
- A program for computing autoionization properties (1993) (4)
- Lifetimes of some2s22p 2P3/2states from variational theory (2016) (4)
- An Mpi Implementation of the Mchf Atomic Structure Package (1996) (4)
- On Solving y" - fy + g with a Boundary Condition at Infinity (1962) (4)
- Electron correlation in the lanthanides:4f2spectrum ofCe2+ (2019) (4)
- Perturbers in the (2D)nd 3Po Rydberg series of sulphur (1987) (4)
- The Effect of Correlation on Spectra of the Lanthanides: Pr3+ (2018) (4)
- On solving ^{”}=+ with a boundary condition at infinity (1962) (4)
- Lifetime of 2s2p23s3P in N II and other allowed triplet transitions (1994) (4)
- Douglas Rayner Hartree (2003) (3)
- Z-Dependent Comparison of the Unrestricted and Conventional Hartree-Fock Approximation (1965) (3)
- A Z-Dependent Representation of the Transition Integral (1976) (3)
- Relativistic calculations for highly charged ions (2005) (3)
- Autoionization rates for core excited 5P states in Na (1989) (3)
- Non-variational Multiconfiguration Hartree-Fock Calculations for Continuum Wave Functions (1993) (3)
- Wave functions for the normal states of Ne+3 and Ne+4 (1957) (3)
- The Self-Consistent Field with Exchange for the Ground State and First Excited State of Fe+13 (1957) (3)
- An Introduction to Relativistic Theory as Implemented in GRASP (2022) (3)
- Multiconfiguration Dirac-Hartree-Fock energies and transition probabilities for transitions in Ne II (2008) (3)
- Approximate solution of schrödinger's equation for atoms (1982) (3)
- Iodine complexes in inert solvents: Part XIII. The system: Iodine-benzene-CCl4 (1962) (3)
- Toward Calculations with Spectroscopic Accuracy: the 2s2.2p 2Po_{3/2} - 2s2p2 4P_{5/2} Excitation Energy in Boron (2013) (2)
- Fine-structure splitting of some high-L, Rydberg states of helium (1989) (2)
- Mixed-valence state treatment for X-ray emission spectra of cuprate superconductors (1994) (2)
- MCHF calculations of hyperfine-induced transitions in the Breit-Pauli approximation (1995) (2)
- Overlapping domain decomposition preconditioners for the generalized Davidson method for the eigenvalue problem (1994) (2)
- Re-Evaluation of the Nuclear Magnetic Octupole Moment of 209Bi (2022) (2)
- An Evaluation of Runge-Kutta Type Methods for Higher Order Differential Equations (1961) (2)
- RELATIVISTIC AND NON-RELATIVISTIC SCF WAVE FUNCTIONS FOR ATOMS AND IONS FROM Z = 2 TO 80, TOGETHER WITH CALCULATIONS OF BINDING ENERGIES, MEAN RADII, SCREENING CONSTANTS, CHARGE DISTRIBUTIONS, AND ELECTRON SHAKE-OFF PROBABILITIES. (1966) (2)
- GRASP Manual for Users (2023) (2)
- Splines in atomic structure calculations (1995) (2)
- Towards B-Spline Atomic Structure Calculations (2021) (2)
- A note on estimating the 1s3d 1D exact, non-relativistic total energy for helium (1982) (2)
- ON THE CALCULATION OF THE VELOCITY OF SOUND IN SEA WATER (1959) (1)
- On the use of RAS configuration interaction expansions to deal with non-orthogonalities in transition probability calculations (1994) (1)
- Relativistic Variational Calculations for Complex Atoms (2009) (1)
- Variational Methods for Atoms and the Virial Theorem (2022) (1)
- Variational calculations of correlated wavefunctions and energies for ground, low-lying as well as highly excited discrete states in many-electron atoms using a new atomic structure theory including electron correlation (2016) (1)
- Limiting behaviour of atomic wave functions for large atomic number. IlI (1959) (1)
- Levels of 2p53p5 in Ar2 (1978) (1)
- The 2p4 3P1,2-2p33s 5S20 and 2p4 3P1,2-2s2p5 3P20 transitions in the oxygen isoelectronic sequence (1998) (1)
- Accurate calculations of isotope shifts and hyperfine structures in light atoms (1995) (1)
- Critical evaluation of Breit and QED effects on the 3 d 9 2 D 3 / 2 → 2 D 5 / 2 transition energy in Co-like ions (2019) (1)
- Large-scale MCHF calculations of isotope shifts and hyperfine structures in light atoms (1995) (1)
- Interpretation by orthogonal operators of Hartree–Fock analyses for Fe vi 3d 2 4p (1988) (1)
- Systematic studies of isotope shifts in light atoms by active set MCHF calculations (1994) (1)
- Theoretical Transition Probabilities and Lifetimes (2005) (1)
- The and transitions in the oxygen isoelectronic sequence (1998) (1)
- The 2s 2 1 S–2s2p 1 P o resonance line in neutral beryllium (1996) (1)
- Accurate f-values for N I and astrophysical implications (1990) (1)
- Robust Preconditioning of Large , Sparse , Symmetric Eigenvalue (1994) (1)
- The effect of correlation on the excitation probability Kr 4p6→Rb+ 4p5 5p following β-decay (1974) (1)
- Systematic calculations transitions in N IV (1995) (1)
- Hartree-Fock Calculations (2019) (1)
- Accurate MCHF Calculations of Atomic Properties of Light Atoms (1995) (1)
- Multiconfiguration Hartree--Fock method for atomic energy levels and transition probabilities (1978) (1)
- Lifetimes of some 2 s 22 p 2 P 3 / 2 states from variational theory (2016) (1)
- G-factor measurements of picosecond states: opportunities and limitations of the recoil-in-vacuum method (2008) (1)
- Diamagnetic susceptibilities calculated from numerical hartree‐fock wave functions (2009) (1)
- MCHF calculations of isotope shifts; I program implementation and test runs II large-scale active space calculations (1994) (1)
- Energy levels and gf-values for Fe XIV (1978) (1)
- Multiconfiguration Hartree-Fock Calculations for Complex Atoms (1984) (0)
- VizieR Online Data Catalog: Silicon isoelectronic sequence data (Jonsson+, 2016) (2015) (0)
- VizieR Online Data Catalog: Mg-like ions energy levels (Gustafsson+, 2017) (2016) (0)
- Large scale systematic calculations of transition probability for neutral nitrogen (1993) (0)
- Interaction of Variational Localized Correlation Functions for Atomic Properties (2011) (0)
- On the use of the Natural Orbitals to compute the hyperfine structure of neutral sodium (2019) (0)
- Professor at the University of Manchester (2003) (0)
- Configuration interaction with separately optimized pair correlation functions (2010) (0)
- Early research at Cambridge University (2003) (0)
- The Partitioned Correlation Function Interaction approach applied to B I, C II and more complex systems (2013) (0)
- Some MCHF results for Rydberg States (1979) (0)
- A Davidson Program for Nding a Few Selected Extreme Eigenpairs of a Large, Sparse, Real, Symmetric Matrix Program Summary (2007) (0)
- Lifetime trends for the n=3 singlet levels of the magnesium sequence (1981) (0)
- Matrix Element Expansions for Atomic Structure (1998) (0)
- VizieR Online Data Catalog: Oxygen-like ions Energies and transition rates (Rynkun+, 2013) (2013) (0)
- Correlation in Many-Electron Systems (2019) (0)
- Photodetachment of He(sup -)1s2s2p(sup 4)P(sup 0) in the Region of the 1s Threshold (2002) (0)
- Large-scale MCHF Calculation of the Li I 4d-4f Energy Separation | NIST (2007) (0)
- Multiconfiguration Hartree–Fock Wave Functions (2022) (0)
- Accurate transition probabilities for light atoms (1995) (0)
- Summers in North America (2003) (0)
- Computer simulation for the optimization of transponders (1983) (0)
- Large-scale MCHF calculations for the resonance transition of Na: Hyperfine constants and transition rates (1995) (0)
- Isotope shift in the electron affinity of sulfur: Observation and theory (2008) (0)
- Introduction to the Laplace Transform (Dio L. Holl and Clair G. Maple) (1960) (0)
- Interaction of Variational Localised Correlation Functions for Atomic Properties of Be I (2012) (0)
- Description of the Be ground state based on the interaction of separately optimized pair correlation functions (2009) (0)
- MCHF and MCHF+BP atomic properties of lithium-like ions (1998) (0)
- Relativistic variational methods and the Virial Theorem (2021) (0)
- Hartree–Fock Calculations (2022) (0)
- The lifetime of 4p54d levels in highly ionized atoms | NIST (2016) (0)
- Determination of atomic data pertinent to the Fusion Energy Science Program (2014) (0)
- Computational atomic structure with GRASP towards heavy atoms and ions of astrophysical interest (2019) (0)
- Variational Pair-Correlation Functions for Automic Properties (2010) (0)
- Atomic Structure Calculations: Encapsulating knowledge in computer codes: LabTalk series Article 47035 (2011) (0)
- MCHF Continuum Wave Functions (2019) (0)
- Multiconfiguration Hartree-Fock Wave Functions (2019) (0)
- Dawn of the computer era (2003) (0)
- Transition Rates for 3s3p2 4P–3s3p4s 4Po Transitions in Al i (2019) (0)
- Revisited relativistic Dirac-Hartree-Fock X-ray scattering factors. I. Neutral atoms with Z = 2-118. (2023) (0)
- Excitation energy of 5d ^2D_3/2 - 6p ^2P_1/2 of atomic Lu by the multiconfiguration Dirac-Hartree-Fock method (2001) (0)
- Evaluating the accuracy of theoretical transition data (2009) (0)
- Revisited relativistic Dirac-Hartree-Fock X-ray scattering factors. II. Chemically relevant cations and selected monovalent anions for atoms with Z = 3-112. (2023) (0)
- Systematic studies of the 2s² 1So - 2s3p1,3Po1 transitions in the Be-like sequence (1996) (0)
- On the energy difference between 1s22s22p 2Po and 1s22s2p2 4P terms in Boron (2012) (0)
- The effect of correlation on the excitation probability Kr 4 p 6 ?Rb + 4 (1974) (0)
- Arrangements for war (2003) (0)
- An extension of the multiconfiguration Hartree-Fock program for continuum functions (1984) (0)
- Control theory and industrial applications (2003) (0)
- The Sulfur electron affinity: A good test case for theoretical isotope shift calculations (2007) (0)
- St. Louis University. (1988) (0)
- Calculations of transition probabilities in the Z sequence (1979) (0)
- Production of atomic data using relativistic multiconfiguration methods (2010) (0)
- Many-body and relativistic effects in the beryllium sequence (1981) (0)
- Education, World War I, and marriage (2003) (0)
- Large-scale MCHF calculations of isotope shifts in light atoms (1995) (0)
- Electric field gradients and quadrupole coupling constants calculated from numerical hartree-fock wave functions (2009) (0)
- A Course in Algol Programming, by G. F. Schaefler. MacMillan, Toronto, 1966. ix + 201 pages. (1967) (0)
- Initial Estimates for Self-Consistent Field Calculations for Atoms with Large Atomic Number (1959) (0)
- Charlotte Froese Fischer: List of Publications (2000) (0)
- Fermi contact interaction constants calculated from numerical hartree‐fock wave functions (2009) (0)
- B-splines in variational atomic structure theory (2007) (0)
- Oscillator strengths for highly ionized atomic systems. Final report, May 1, 1977-December 31, 1979 (1979) (0)
- Theoretical Energy Levels of F Rydberg Series for Mg I, AI II, and Sill1 (1980) (0)
- Returning to Cambridge (2003) (0)
- A multiconfiguration hartree-fock approach to atomic structure calculations (2009) (0)
- Lifetimes of some 2s22p 2P3=2 states from variational theory | NIST (2016) (0)
- Evaluation of Breit and QED effects on the $3d^9\ ^2D_{3/2}\rightarrow 3d^9\ ^2D_{5/2}$ transition energy using different approximations (2018) (0)
- The Computational Atomic Structure Group – Code Development and Available Resources (2014) (0)
- Introduction to programming the IBM 1620 (1964) (0)
- Orthogonality considerations in the computation of autoionization widths (1992) (0)
- ACCURATE MCHF/MCDF TRANSITION RATES (1998) (0)
- The ATSP2K and GRASP2K Multiconfiguration Atomic Structure Program Packages (2013) (0)
- Radio waves in the atmosphere (2003) (0)
- MCHF calculations of isotope shifts in calcium (1992) (0)
- Computational atomic structure developments with GRASP towards heavy atoms and ions of astrophysical interest (2019) (0)
- The final years (2003) (0)
- Study of Gadolinium ionization energy (1999) (0)
- MCDF calculations of transition rates of astrophysical interest in neutral Technetium (1999) (0)
- Atomic and Molecular Properties from Astronomers' Sky Spectra (2003) (0)
- Accurate MCHF oscillator strengths in B and B (1994) (0)
- Exact maps in density functional theory for lattice models (2016) (0)
- Non-orthogonalities in transition matrices: No problem (1994) (0)
- The effect of correlation on line strengths in third row elements (2005) (0)
- Laminar boundary layer theory (2003) (0)
- General multi-configuration Hartree--Fock program: MCHF77. [In FORTRAN (double precision) for IBM 360 and 370] (1977) (0)
- Theoretical study of hyperfine structure of ground state in neutral Carbon (2015) (0)
- Accurate MCHF calculations of the oscillator strength and hyperfine structures in the sodium resonance transition (1995) (0)
- Theoretical Studies of Atomic Transitions (2005) (0)
- Theoretical atomic properties for light atoms (1998) (0)
- MCHF calculations for 2s² 1S - 2s3p 1Po transitions in some Be-like systems (1995) (0)
- ------------------------------------------------------------- - (2009) (0)
- Massive Calculations of Atomic Properties with High Accuracy for Boron-like Iron and other Ions of Astrophysical Interest (2013) (0)
- Theoretical energy levels of /sup 3/F/sup 0/ Rydberg series for Mg I, Al II, and Si III. [Multiconfiguration Hartree-Fock] (1979) (0)
- Configuration interaction in the spin‐polarized hartree–fock approximation (2009) (0)
- Design of a database for atoms (1985) (0)
- Advances in atomic theory (2003) (0)
- Introduction (2022) (0)
- Lifetimes of Low-Lying P , D, and F States of the AI I Isoelectronic Sequence (1981) (0)
- Theoretical studies of atomic transitions. Renewal progress report, April 1, 1994--March 31, 1997 (1996) (0)
- Variational Pair-Correlation Functions for Atomic Properties (Cairns) (2010) (0)
- Transition probability of the /sup 1/S/sub 0/. -->. /sup 1/D/sub 2/ emission of atomic oxygen (1982) (0)
- Oscillator strengths for the weak 3s ²S - 4p ²Po transition in Mg II (1998) (0)
- MCHF-BP fine-structure splittings and transition probabilities in the ground configuration of nitrogen sequence (1983) (0)
- Hyperfine Quenching of the 1s²2s2p ³Po0 in C III and N IV and their astrophysical interest (1995) (0)
- A new program package for atomic structure calculations (1982) (0)
- Relativistic Effects (2019) (0)
- The new quantum mechanics (2003) (0)
- Allowed and Forbidden Transitions (2019) (0)
- A Partitioned Correlation Function Approach for Atomic Properties (Washington) (2012) (0)
- O ct 2 01 3 Toward calculations with spectroscopic accuracy : the 2 s 2 2 p (2013) (0)
- Many-body and relativistic effects in the Be sequence (1981) (0)
- Theoretical studies of atomic transitions. Progress report, March 15, 1986-March 14, 1987 (1987) (0)
- Effect of correlation in the 3d/sup n/ core on the resonance transition in Cu II. [Multiconfiguration Hartree-Fock] (1979) (0)
- Spline-Galerkin calculations of Rydberg series and photoionization (1993) (0)
- A trip to Australia (2003) (0)
- Accurate calculations of isotope shifts in light atoms (1996) (0)
- The Hartree family (2003) (0)
- VizieR Online Data Catalog: Carbon isoelectronic sequence data (Ekman+, 2014) (2014) (0)
- Parametric analysis and ab initio calculations of isotope shifts in neutral and singly-ionized nickel (2001) (0)
- Effect of correlation on the excitation probability Kr 4p$sup 6$ $Yields$ Rb$sup +$ 4p$sup 5$5p following $beta$-decay (1974) (0)
- Configuration State Functions and Matrix Elements of the Hamiltonian (2019) (0)
- Atomic structure research using EDSAC (2003) (0)
- Physica Scripta . Vol . T 78 , 33 È 46 , 1998 Atomic Structure Variational Calculations in Spectroscopy (1999) (0)
- Ab initio calculations of the Sulfur electron-affinity in the MCHF approach (2007) (0)
- Atomic Structure Calculations with Spectroscopic Accuracy – Implications for Laboratory Work (2014) (0)
- A Partitioned Correlation Function approach for atomic properties (Göteborg) (2012) (0)
- Transition Rates for 3 s 3 p 2 4 P − 3 s 3 p 4 s 4 P o Transitions in Al I (2019) (0)
- Oscillator strengths for highly ionized atomic systems. Progress report, May 1, 1977--April 30, 1978. [Summaries of research activities at Pennsylvania State Univ] (1978) (0)
- Oscillator strengths for highly ionized atomic systems. [Summaries of research activities at Pennsylvania State Univ] (1979) (0)
- Hyperfine quenching of 1s²2s2p ³Po0 in C III and N IV (1995) (0)
- Introduction (2019) (0)
- B-spline Galerkin methods for the Dirac equation (2008) (0)
- Large-scale relativistic calculations of ionization energies and total binding energies of all atoms and positive atomic ions with nuclear charge Z = 1-110 (2015) (0)
- A method for finding the asymptotic behavior of a function from its Laplace transform (1954) (0)
- Isotope and Hyperfine Effects (2019) (0)
- J un 2 01 9 Electron affinities of At and its homologous elements Cl , Br , (0)
- Core-polarization effects in neutral technetium (2000) (0)
- Comparison between model potential and MCHF approaches in Ca II (1990) (0)
- Energy levels and lifetimes of 2P/sup 5/3S3D quartets in Na I (1986) (0)
- Two-Electron Systems (2019) (0)
- Mathematical Laboratory, numerical analysis, and teaching (2003) (0)
- Introduction to Programming the IBM 1620 (1965) (0)
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