diff --git a/source/_sources/04Publications.rst b/source/_sources/04Publications.rst index 0a32df8..74049b7 100644 --- a/source/_sources/04Publications.rst +++ b/source/_sources/04Publications.rst @@ -13,13 +13,17 @@ Publications 2024 #################### +- | Principal deuterium Hugoniot via quantum Monte Carlo and :math:`\Delta` -learning + | G. Tenti, K. Nakano, A. Tirelli, S. Sorella, M. Casula + | `Phys. Rev. B 110, L041107 (2024) <\https://doi.org/10.1103/PhysRevB.110.L041107>`_ + .. 2024NAK1 .. article - + - | Beyond Single-Reference Fixed-Node Approximation in Ab Initio Diffusion Monte Carlo Using | Antisymmetrized Geminal Power Applied to Systems with Hundreds of Electrons | K. Nakano, S. Sorella, D. Alfè, and A. Zen - | `J. Chem. Theory Comput. in press (2024) `_ + | `J. Chem. Theory Comput. 20, 4591-4604 (2024) `_ .. 2024NAK2 .. article @@ -46,6 +50,10 @@ Publications | K. Nakano, O. Kohulák, A. Raghav, M. Casula, and S. Sorella | `J. Chem. Phys. 159, 224801 (2023) `_ +- | Thermal dependence of the hydrated proton and optimal proton transfer in the protonated water hexamer + | F. Mouhat, M. Peria, T. Morresi, R. Vuilleumier, A. M. Saitta, M. Casula + | `Nat. Comm. 14, 6930 (2023) `_ + .. 2023RAG .. article diff --git a/source/_static/07logo/HANAMI_logo.png b/source/_static/07logo/HANAMI_logo.png new file mode 100644 index 0000000..031c3e0 Binary files /dev/null and b/source/_static/07logo/HANAMI_logo.png differ diff --git a/source/_static/07logo/TREX_LOGO.png b/source/_static/07logo/TREX_LOGO.png new file mode 100644 index 0000000..53658de Binary files /dev/null and b/source/_static/07logo/TREX_LOGO.png differ diff --git a/source/index.rst b/source/index.rst index 1398604..ff82e67 100644 --- a/source/index.rst +++ b/source/index.rst @@ -8,15 +8,17 @@ Welcome to our TurboRVB website .. figure:: /_static/07logo/logo.png :width: 800px - -News -######################## -- | K. Nakano, et al. have published a paper titled '*Beyond Single-Reference Fixed-Node Approximation in Ab Initio Diffusion Monte Carlo Using Antisymmetrized Geminal Power Applied to Systems with Hundreds of Electrons*' in `J. Chem. Theory Comput. in press (2024) `_. +Most Recent Publications +######################## + +- | G. Tenti et al. have published a paper titled '*Principal deuterium Hugoniot via quantum Monte Carlo and* :math:`\Delta` *-learning*' in `Phys. Rev. B 110, L041107 (2024) <\https://doi.org/10.1103/PhysRevB.110.L041107>`_. +- | K. Nakano et al. have published a paper titled '*Beyond Single-Reference Fixed-Node Approximation in Ab Initio Diffusion Monte Carlo Using Antisymmetrized Geminal Power Applied to Systems with Hundreds of Electrons*' in `J. Chem. Theory Comput. 20, 4591-4604 (2024) `_. - | K. Nakano et al. have published a paper titled '*Efficient calculation of unbiased atomic forces in ab initio variational Monte Carlo*' in `Phys. Rev. B 109, 205151 (2024) `_. - | R. Taureau et al. have published a paper titled '*Quantum symmetrization transition in superconducting sulfur hydride from quantum Monte Carlo and path integral molecular dynamics*' in `Npj Comput. Mater. 10, 56 (2024) `_. - | K. Nakano et al. have published a paper titled '*TurboGenius: Python suite for high-throughput calculations of ab initio quantum Monte Carlo methods*' in `J. Chem. Phys. 159, 224801 (2023) `_. +- | F. Mouhat et al. have published a paper titled '*Thermal dependence of the hydrated proton and optimal proton transfer in the protonated water hexamer*' in `Nat. Comm. 14, 6930 (2023) `_. - | TurboRVB is now an `open-source project `_! **ver.1.0.0** !! - | A. Raghav et al. have published a paper titled '*Toward Chemical Accuracy Using the Jastrow Correlated Antisymmetrized Geminal Power Ansatz*' in `J. Chem. Theory Comput. 19, 2222-2229 (2023) `_. - | L. Monacelli et al. have published a paper titled '*Quantum phase diagram of high-pressure hydrogen*' in `Nat. Phys. 19, 845–850 (2023) `_. @@ -43,6 +45,19 @@ TurboRVB is distinguishable from other QMC codes in the following features: - The implementation of an adjoint algorithmic differentiation allows us to differentiate many-body wave functions efficiently and to perform structural optimizations and calculate molecular dynamics. +Sponsors +######################## +TurboRVB is now supported by the `HANAMI consortium `_. + +.. figure:: /_static/07logo/HANAMI_logo.png + :width: 400px + +TurboRVB project has been a flagship code of the `European TREX Center of Excellence `_. + +.. figure:: /_static/07logo/TREX_LOGO.png + :width: 200px + + .. toctree:: :maxdepth: 1 :caption: Contents: