Alexander Yu Sokolov

6PUBLICATIONS
69CO-AUTHORS
Radiation and matterStatistical mechanics, physical combinatorics and mathematical aspects of condensed matterFormal methods for softwareTheoretical quantum chemistryMathematical aspects of general relativity
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Publications (6)

|Feb 20, 2021
Efficient implementation of the single-reference algebraic diagrammatic construction theory for charged excitations: Applications to the TEMPO radical and DNA base pairs.

Samragni Banerjee, Alexander Yu Sokolov

|Dec 31, 2020
Assessing the orbital-optimized unitary Ansatz for density cumulant theory.

Jonathon P Misiewicz, Justin M Turney, Henry F Schaefer

|Jul 17, 2020
Recent developments in the PySCF program package.

Qiming Sun, Xing Zhang, Samragni Banerjee

|May 17, 2020
Psi4 1.4: Open-source software for high-throughput quantum chemistry.

Daniel G A Smith, Lori A Burns, Andrew C Simmonett

|Dec 16, 2019
Third-order algebraic diagrammatic construction theory for electron attachment and ionization energies: Conventional and Green's function implementation.

Samragni Banerjee, Alexander Yu Sokolov

|Dec 04, 2018
Multi-reference algebraic diagrammatic construction theory for excited states: General formulation and first-order implementation.

Alexander Yu Sokolov

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Frequent Collaborators

2 joint publications

Samragni Banerjee

2 joint publications

Henry F Schaefer

2 joint publications

Maximilian Scheurer

2 joint publications

Justin M Turney