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authors [2025/05/06 06:11] visscherauthors [2025/09/22 20:15] (current) agustin_aucar
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 ORCID: [[https://orcid.org/0000-0002-7748-6243|0000-0002-7748-6243]]\\ ORCID: [[https://orcid.org/0000-0002-7748-6243|0000-0002-7748-6243]]\\
  general structure, relativistic coupled cluster methods, direct CI module,  general structure, relativistic coupled cluster methods, direct CI module,
- spinfree Dirac equation, index transformation routines, interfaces+ spinfree Dirac equation, index transformation routines, interfaces
-  +
 </columns> </columns>
 ---- ----
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  open-shell Hartree-Fock, Kramers-restricted MCSCF,  open-shell Hartree-Fock, Kramers-restricted MCSCF,
  4c ESR,  4c ESR,
- parallellization of CI, London orbitals NMR, two-step X2C (BSSinf, DKHinf), administrator + parallelization of CI, London orbitals NMR, two-step X2C (BSSinf, DKHinf), administrator
 </columns> </columns>
 ---- ----
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 ORCID: [[https://orcid.org/0000-0002-7658-1847|0000-0002-7658-1847]]\\ ORCID: [[https://orcid.org/0000-0002-7658-1847|0000-0002-7658-1847]]\\
  SDFT linear and quadratic response, higher order response properties, visualization,  SDFT linear and quadratic response, higher order response properties, visualization,
- PV NMR properties, XC evaluation, CMake framework, testing, dashboard, website + PV NMR properties, XC evaluation, CMake framework, testing, dashboard, website
 </columns> </columns>
 ---- ----
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 https://pro.univ-lille.fr/andre-severo-pereira-gomes \\ https://pro.univ-lille.fr/andre-severo-pereira-gomes \\
 ORCID: [[https://orcid.org/0000-0002-5437-2251|0000-0002-5437-2251]]\\ ORCID: [[https://orcid.org/0000-0002-5437-2251|0000-0002-5437-2251]]\\
- 
  Frozen-density embedding (FDE) module (DFT-in-DFT and WFT-in-DFT embedding), FDE contributions to molecular properties (electric, magnetic), equation of motion coupled cluster (EOMCC)  Frozen-density embedding (FDE) module (DFT-in-DFT and WFT-in-DFT embedding), FDE contributions to molecular properties (electric, magnetic), equation of motion coupled cluster (EOMCC)
 </columns> </columns>
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 ORCID: [[https://orcid.org/0000-0003-3501-0957|0000-0003-3501-0957]]\\ ORCID: [[https://orcid.org/0000-0003-3501-0957|0000-0003-3501-0957]]\\
  Nuclear spin-rotation constants, molecular rotational g-tensors  Nuclear spin-rotation constants, molecular rotational g-tensors
 +</columns>
 +----
 +<columns 100% first column attributes 15% second column attributes ->
 +{{::jjaucar.jpg?100|}}
 +<newcolumn>
 +**Juan J. Aucar** \\
 +ORCID: [[https://orcid.org/0000-0002-9065-2242|0000-0002-9065-2242]]\\
 +Parity-violating effects in electric field gradients
 </columns> </columns>
 ---- ----
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 **Chima Chibueze** \\ **Chima Chibueze** \\
 ORCID: [[https://orcid.org/0009-0008-3007-4808|0009-0008-3007-4808]]\\ ORCID: [[https://orcid.org/0009-0008-3007-4808|0009-0008-3007-4808]]\\
- Relativistic coupled cluster,  ExaCorr Development : open-shell systems+ Relativistic coupled cluster,  ExaCorr Development: open-shell systems
 </columns> </columns>
 ---- ----
authors.1746511872.txt.gz · Last modified: 2025/05/06 06:11 by visscher

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