Dr. Vijay Gopal CHILKURI
Dr.
Vijay Gopal
CHILKURI
AMU iSm2 Service 561
Campus Scientifique de St Jérôme
13397
Marseille cedex 20
Phone number :
Other websites :
Date of entry :
01/09/2022
PhD submission :
16/10/2015
Publications (7)
Reference
Graphical abstract
HAL
TREXIO: A File Format and Library for Quantum Chemistry
Evgeny Posenitskiy, Vijay Gopal Chilkuri, Abdallah Ammar, Michał Hapka, Katarzyna Pernal, Ravindra Shinde, Edgar Josué Landinez Borda, Claudia Filippi, Kosuke Nakano, Otto Kohulák, Sandro Sorella, Pablo de Oliveira Castro, William Jalby, Pablo López Ríos, Ali Alavi, Anthony Scemama, Journal of Chemical Physics, 2023, 158. <hal-04011588>
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Diffusion Monte Carlo using domains in configuration space
Roland Assaraf, Emmanuel Giner, Vijay Gopal Chilkuri, Pierre-Francois Loos, Anthony Scemama, Michel Caffarel, Physical Review B, 2023, 107, 035130. <hal-03826402>
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Engineering the magnetic coupling and anisotropy at the molecule–magnetic surface interface in molecular spintronic devices
Victoria E. Campbell, Monica Tonelli, Irene Cimatti, Jean-Baptiste Moussy, Ludovic Tortech, Yannick J. Dappe, Eric Rivière, Régis Guillot, Sophie Delprat, Richard Mattana, Pierre Seneor, Philippe Ohresser, Fadi Choueikani, Edwige Otero, Florian Koprowiak, Vijay Gopal Chilkuri, Nicolas Suaud, Nathalie Guihéry, Anouk Galtayries, Frederic Miserque, Marie-Anne Arrio, Philippe Sainctavit, Talal Mallah, Nature Communications, 2016, 7, 13646. <hal-01414673>
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High-Spin Chains and Crowns from Double-Exchange Mechanism
Vijay Gopal Chilkuri, Nicolas Suaud, Nathalie Guihéry, Crystals, 2016, 6, 39. <hal-01299705>
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The Electronic Structure of Short Carbon Nanotubes: The Effects of Correlation
Vijay Gopal Chilkuri, Stefano Evangelisti, Thierry Leininger, Antonio Monari, Advances in Condensed Matter Physics, 2015, 475890. <hal-01377156>
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When a single hole aligns several spins: Double exchange in organic systems
Georges Trinquier, Vijay Gopal Chilkuri, Jean-Paul Malrieu, Journal of Chemical Physics, 2014, 140, 204113. <hal-01071976>
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In Search of Organic Compounds Presenting a Double Exchange Phenomenon
Vijay Gopal Chilkuri, Georges Trinquier, Nadia Ben Amor, Jean-Paul Malrieu, Nathalie Guihéry, Journal of Chemical Theory and Computation, 2013, 9, 4805-4815. <hal-00937326>
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Chapters of books (1)
Reference
Graphical abstract
HAL
Vijay Gopal Chilkuri, Thomas Applencourt, Kevin Gasperich, Pierre-Francois Loos, Anthony Scemama. Spin-adapted selected configuration interaction in a determinant basis. Advances in Quantum Chemistry, Academic Press, 2021, Advances in Quantum Chemistry, ⟨10.1016/bs.aiq.2021.04.001⟩. ⟨hal-02468242v2⟩
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| Reference | Graphical abstract | HAL |
|---|---|---|
|
TREXIO: A File Format and Library for Quantum Chemistry |
|
✓ |
|
Diffusion Monte Carlo using domains in configuration space |
|
✓ |
|
Engineering the magnetic coupling and anisotropy at the molecule–magnetic surface interface in molecular spintronic devices |
|
✓ |
|
High-Spin Chains and Crowns from Double-Exchange Mechanism |
|
✓ |
|
The Electronic Structure of Short Carbon Nanotubes: The Effects of Correlation |
|
✓ |
|
When a single hole aligns several spins: Double exchange in organic systems |
|
✖ |
|
In Search of Organic Compounds Presenting a Double Exchange Phenomenon |
|
✖ |
| Reference | Graphical abstract | HAL |
|---|---|---|
|
Vijay Gopal Chilkuri, Thomas Applencourt, Kevin Gasperich, Pierre-Francois Loos, Anthony Scemama. Spin-adapted selected configuration interaction in a determinant basis. Advances in Quantum Chemistry, Academic Press, 2021, Advances in Quantum Chemistry, ⟨10.1016/bs.aiq.2021.04.001⟩. ⟨hal-02468242v2⟩ |
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