An improved bound on the electron's electric dipole moment

TS Roussy, L Caldwell, T Wright, WB Cairncross… - Science, 2023 - science.org
The imbalance of matter and antimatter in our Universe provides compelling motivation to
search for undiscovered particles that violate charge-parity symmetry. Interactions with …

Precision measurement of the electron's electric dipole moment using trapped molecular ions

WB Cairncross, DN Gresh, M Grau, KC Cossel… - Physical review …, 2017 - APS
We describe the first precision measurement of the electron's electric dipole moment (de)
using trapped molecular ions, demonstrating the application of spin interrogation times over …

The DIRAC code for relativistic molecular calculations

T Saue, R Bast, ASP Gomes, HJA Jensen… - The Journal of …, 2020 - pubs.aip.org
DIRAC is a freely distributed general-purpose program system for one-, two-, and four-
component relativistic molecular calculations at the level of Hartree–Fock, Kohn–Sham …

Generalized relativistic effective core potentials for actinides

NS Mosyagin, AV Zaitsevskii… - … Journal of Quantum …, 2016 - Wiley Online Library
Actinide compounds are very intriguing objects for the quantum chemistry because, on the
one hand, these compounds are of great scientific and technological interest and, on the …

Observation of an inner-shell orbital clock transition in neutral ytterbium atoms

T Ishiyama, K Ono, T Takano, A Sunaga… - Physical Review Letters, 2023 - APS
We observe a weakly allowed optical transition of atomic ytterbium from the ground state to
the metastable state 4 f 13 5 d 6 s 2 (J= 2) for all five bosonic and two fermionic isotopes with …

Equation-of-motion coupled-cluster theory based on the 4-component Dirac–Coulomb (–Gaunt) Hamiltonian. Energies for single electron detachment, attachment …

A Shee, T Saue, L Visscher… - The Journal of chemical …, 2018 - pubs.aip.org
We report in this paper an implementation of a 4-component relativistic Hamiltonian based
Equation-of-Motion Coupled-Cluster with singles and doubles (EOM-CCSD) theory for the …

Spectroscopy on the electron-electric-dipole-moment–sensitive states of

KB Ng, Y Zhou, L Cheng, N Schlossberger, SY Park… - Physical Review A, 2022 - APS
An excellent candidate molecule for the measurement of the electron's electric dipole
moment (eEDM) is thorium monofluoride (ThF+) because the eEDM–sensitive state, 3 Δ 1, is …

Relativistic Fock space coupled cluster method for many-electron systems: Non-perturbative account for connected triple excitations

AV Oleynichenko, A Zaitsevskii, LV Skripnikov, E Eliav - Symmetry, 2020 - mdpi.com
The Fock space relativistic coupled cluster method (FS-RCC) is one of the most promising
tools of electronic structure modeling for atomic and molecular systems containing heavy …

Methods, analysis, and the treatment of systematic errors for the electron electric dipole moment search in thorium monoxide

J Baron, WC Campbell, D DeMille… - New Journal of …, 2017 - iopscience.iop.org
We recently set a new limit on the electric dipole moment of the electron (eEDM)(J Baron et
al and ACME collaboration 2014 Science 343 269–272), which represented an order-of …

Theoretical aspects of radium-containing molecules amenable to assembly from laser-cooled atoms for new physics searches

T Fleig, D DeMille - New Journal of Physics, 2021 - iopscience.iop.org
We explore the possibilities for a next-generation electron-electric-dipole-moment
experiment using ultracold heteronuclear diatomic molecules assembled from a …