Image de couverture de livre

Modular Construction of Jastrow Factors for the Transcorrelated Method

Fuente: arXiv

Enregistré dans:

Détails bibliographiques
Auteurs principaux:	Haupt, J. Philip, Filip, Maria-Andreea, Christlmaier, Evelin Martine Corvid, Cheng, Yifan, Hauskrecht, Johannes, Alavi, Ali
Format:	Preprint
Publié:	2025
Sujets:	Chemical Physics Computational Physics
Accès en ligne:	Acceder al recurso
Tags:	Ajouter un tag Pas de tags, Soyez le premier à ajouter un tag!

Documents similaires

Transcorrelated Methods Applied to Second Row Elements
par: Filip, Maria-Andreea, et autres
Publié: (2024)

Transcorrelated Theory with Pseudopotentials
par: Simula, Kristoffer, et autres
Publié: (2024)

Deterministic Optimisation of Jastrow Factors
par: Filip, Maria-Andreea, et autres
Publié: (2025)

Transcorrelated Methods for Multireference Problems
par: Haupt, J. Philip, et autres
Publié: (2025)

A Transcorrelated Wave-Function Framework for Solids: An Application to Bulk and Defected Silicon
par: Simula, Kristoffer, et autres
Publié: (2025)

Transcorrelated Theory for Transition Metal Atoms
par: Simula, Kristoffer, et autres
Publié: (2025)

Orbital optimisation in xTC transcorrelated methods
par: Kats, Daniel, et autres
Publié: (2024)

Ab Initio Transcorrelated Method enabling accurate Quantum Chemistry on near-term Quantum Hardware
par: Dobrautz, Werner, et autres
Publié: (2023)

Studies on the Transcorrelated Method
par: Lee, Nicholas, et autres
Publié: (2023)

Non-iterative Triples for Transcorrelated Coupled Cluster Theory
par: Mörchen, Maximilian, et autres
Publié: (2024)

Towards Balanced Description of Ground and Excited States with Transcorrelated F12 Methods
par: Masteran, Conner, et autres
Publié: (2025)

Beyond asymptotic reasoning: the practicalities of a quantum ground state projector based on the wall-Chebyshev expansion
par: Filip, Maria-Andreea, et autres
Publié: (2025)

Compactifying Electronic Wavefunctions I: Error-Mitigated Transcorrelated DMRG
par: Araújo, Bruna G. M., et autres
Publié: (2025)

Partial separability of the Schroedinger equation combined with a Jastrow factor
par: Sech, Claude Le, et autres
Publié: (2025)

X marks the spot: accurate energies from intersecting extrapolations of continuum quantum Monte Carlo data
par: Hosseini, Seyed Mohammadreza, et autres
Publié: (2024)

Excited state preparation on a quantum computer through adiabatic light-matter coupling
par: Burton, Hugh G. A., et autres
Publié: (2025)

Real-Space Chemistry on Quantum Computers: A Fault-Tolerant Algorithm with Adaptive Grids and Transcorrelated Extension
par: Feniou, César, et autres
Publié: (2025)

Variational Quantum Imaginary Time Evolution for Matrix Product State Ansatz with Tests on Transcorrelated Hamiltonians
par: Li, Hao-En, et autres
Publié: (2024)

Towards Efficient Quantum Computing for Quantum Chemistry: Reducing Circuit Complexity with Transcorrelated and Adaptive Ansatz Techniques
par: Magnusson, Erika, et autres
Publié: (2024)

Perturbation Calculation of the Uniform Electron Gas with a Transcorrelated Hamiltonian
par: Luo, Hongjun, et autres
Publié: (2022)

Shallow Electronic State Preparation for Quantum Chemistry with Quantum Monte Carlo Pre-Selection
par: Welling, Eline, et autres
Publié: (2026)

Beyond real: Alternative unitary cluster Jastrow models for molecular electronic structure calculations on near-term quantum computers
par: Tkachenko, Nikolay V., et autres
Publié: (2025)

Basis-free neural-network geminal and Jastrow factors for variational Monte Carlo
par: Kessler, Jan, et autres
Publié: (2026)

Individual and cooperative superexchange enhancement in cuprates
par: Jiang, Tonghuan, et autres
Publié: (2025)

Rapidly convergent quantum Monte Carlo using a Chebyshev projector
par: Zhao, Zijun, et autres
Publié: (2024)

Nodal error behind discrepancies between coupled cluster and diffusion Monte Carlo in hydrogen-bonded systems
par: Lambie, S., et autres
Publié: (2025)

Compactification of Determinant Expansions via Transcorrelation
par: Ammar, Abdallah, et autres
Publié: (2024)

QDK/Chemistry: A Modular Toolkit for Quantum Chemistry Applications
par: Baker, Nathan A., et autres
Publié: (2026)

The Ridge Integration Method and its Application to Molecular Sieving, Demonstrated for Gas Purification via Graphdiyne Membranes
par: Binder, Christian W., et autres
Publié: (2025)

Enhanced Deep Potential Model for Fast and Accurate Molecular Dynamics; Application to the Hydrated Electron
par: Gao, Ruiqi, et autres
Publié: (2024)

Rational Construction of Stochastic Numerical Methods for Molecular Sampling
par: Leimkuhler, Benedict, et autres
Publié: (2012)

Functionality Optimization for Singlet Fission Rate Screening in the Full-Dimensional Molecular and Intermolecular Coordinate Space
par: Greiner, Johannes, et autres
Publié: (2024)

On the applicability of CCSD(T) for dispersion interactions in large conjugated systems
par: Lambie, S., et autres
Publié: (2024)

NATPS: Nonadiabatic Transition Path Sampling Using Time-Reversible MASH Dynamics
par: Yang, Xiran, et autres
Publié: (2026)

Parallel Multi-Coordinate Descent Methods for Full Configuration Interaction
par: Zhang, Yuejia, et autres
Publié: (2024)

Adaptive Transition State Refinement with Learned Equilibrium Flows
par: Darouich, Samir, et autres
Publié: (2025)

Opportunities and Challenges in Unsupervised Learning: The Case of Aqueous Electrolyte Solutions
par: Sormani, Giulia, et autres
Publié: (2025)

Benchmark Phaseless Auxiliary-Field Quantum Monte Carlo Method for Small Molecules
par: Sukurma, Z., et autres
Publié: (2023)

The Staggered Mesh Method: Accurate Exact Exchange towards the Thermodynamic Limit for Solids
par: Quiton, Stephen Jon, et autres
Publié: (2024)

Benchmarking distinguishable cluster methods to platinum standard CCSDT(Q) non covalent interaction energies in the A24 dataset
par: Lambie, S., et autres
Publié: (2025)