Efficient emulators for scattering using eigenvector continuation

R.J. Furnstahl (Department of Physics, The Ohio State University, Columbus, OH 43210, USA) ; A.J. Garcia (Department of Physics, The Ohio State University, Columbus, OH 43210, USA) ; P.J. Millican (Department of Physics, The Ohio State University, Columbus, OH 43210, USA) ; Xilin Zhang (Department of Physics, The Ohio State University, Columbus, OH 43210, USA)

Eigenvector continuation (EC) has been shown to accurately and efficiently reproduce ground states for targeted sets of Hamiltonian parameters. It uses as variational basis vectors the corresponding ground-state eigensolutions from selected other sets of parameters. Here we extend the EC approach to scattering using the Kohn variational principle. We first test it using a model for S-wave nucleon-nucleon scattering and then demonstrate that it also works to give accurate predictions for non-local potentials, charged-particle scattering, complex optical potentials, and higher partial waves. These proofs-of-principle validate EC as an accurate emulator for applying Bayesian inference to parameter estimation constrained by scattering observables. The efficiency of such emulators is because the accuracy is achieved with a small number of variational basis elements and the central computations are just linear algebra calculations in the space spanned by this basis.

{
  "license": [
    {
      "url": "http://creativecommons.org/licenses/by/3.0/", 
      "license": "CC-BY-3.0"
    }
  ], 
  "copyright": [
    {
      "holder": "The Author(s)", 
      "statement": "The Author(s)", 
      "year": "2020"
    }
  ], 
  "control_number": "56519", 
  "_oai": {
    "updated": "2020-10-01T18:44:24Z", 
    "id": "oai:repo.scoap3.org:56519", 
    "sets": [
      "PLB"
    ]
  }, 
  "authors": [
    {
      "affiliations": [
        {
          "country": "USA", 
          "value": "Department of Physics, The Ohio State University, Columbus, OH 43210, USA"
        }
      ], 
      "surname": "Furnstahl", 
      "email": "furnstahl.1@osu.edu", 
      "full_name": "Furnstahl, R.J.", 
      "given_names": "R.J."
    }, 
    {
      "surname": "Garcia", 
      "given_names": "A.J.", 
      "affiliations": [
        {
          "country": "USA", 
          "value": "Department of Physics, The Ohio State University, Columbus, OH 43210, USA"
        }
      ], 
      "full_name": "Garcia, A.J.", 
      "orcid": "0000-0003-1723-3225", 
      "email": "garcia.823@osu.edu"
    }, 
    {
      "affiliations": [
        {
          "country": "USA", 
          "value": "Department of Physics, The Ohio State University, Columbus, OH 43210, USA"
        }
      ], 
      "surname": "Millican", 
      "email": "millican.7@osu.edu", 
      "full_name": "Millican, P.J.", 
      "given_names": "P.J."
    }, 
    {
      "surname": "Zhang", 
      "given_names": "Xilin", 
      "affiliations": [
        {
          "country": "USA", 
          "value": "Department of Physics, The Ohio State University, Columbus, OH 43210, USA"
        }
      ], 
      "full_name": "Zhang, Xilin", 
      "orcid": "0000-0001-9278-5359", 
      "email": "zhang.10038@osu.edu"
    }
  ], 
  "_files": [
    {
      "checksum": "md5:5b900a0aa18b355eda74132ddee89fac", 
      "filetype": "xml", 
      "bucket": "4433e5f8-e2ee-4ed0-9403-0736012c9be2", 
      "version_id": "ffc1bf44-de94-4193-b8e2-b4863e946925", 
      "key": "10.1016/j.physletb.2020.135719.xml", 
      "size": 134009
    }, 
    {
      "checksum": "md5:0b68bdb47698853117e6972effd68656", 
      "filetype": "pdf", 
      "bucket": "4433e5f8-e2ee-4ed0-9403-0736012c9be2", 
      "version_id": "af57938d-df69-4377-952b-69e1fa95110e", 
      "key": "10.1016/j.physletb.2020.135719.pdf", 
      "size": 463524
    }, 
    {
      "checksum": "md5:519ade82dd0d24aae8f067d1c367b98d", 
      "filetype": "pdf/a", 
      "bucket": "4433e5f8-e2ee-4ed0-9403-0736012c9be2", 
      "version_id": "7f325ba0-59c3-4d4d-a475-4bd8a06f4cf7", 
      "key": "10.1016/j.physletb.2020.135719_a.pdf", 
      "size": 804397
    }
  ], 
  "record_creation_date": "2020-08-26T14:30:27.837387", 
  "titles": [
    {
      "source": "Elsevier", 
      "title": "Efficient emulators for scattering using eigenvector continuation"
    }
  ], 
  "collections": [
    {
      "primary": "Physics Letters B"
    }
  ], 
  "dois": [
    {
      "value": "10.1016/j.physletb.2020.135719"
    }
  ], 
  "publication_info": [
    {
      "journal_volume": "809 C", 
      "journal_title": "Physics Letters B", 
      "material": "article", 
      "artid": "135719", 
      "year": 2020
    }
  ], 
  "$schema": "http://repo.scoap3.org/schemas/hep.json", 
  "abstracts": [
    {
      "source": "Elsevier", 
      "value": "Eigenvector continuation (EC) has been shown to accurately and efficiently reproduce ground states for targeted sets of Hamiltonian parameters. It uses as variational basis vectors the corresponding ground-state eigensolutions from selected other sets of parameters. Here we extend the EC approach to scattering using the Kohn variational principle. We first test it using a model for S-wave nucleon-nucleon scattering and then demonstrate that it also works to give accurate predictions for non-local potentials, charged-particle scattering, complex optical potentials, and higher partial waves. These proofs-of-principle validate EC as an accurate emulator for applying Bayesian inference to parameter estimation constrained by scattering observables. The efficiency of such emulators is because the accuracy is achieved with a small number of variational basis elements and the central computations are just linear algebra calculations in the space spanned by this basis."
    }
  ], 
  "imprints": [
    {
      "date": "2020-08-26", 
      "publisher": "Elsevier"
    }
  ], 
  "acquisition_source": {
    "date": "2020-10-01T20:30:38.878758", 
    "source": "Elsevier", 
    "method": "Elsevier", 
    "submission_number": "1d423f8e041411ebbd0e02163e01809a"
  }
}
Published on:
26 August 2020
Publisher:
Elsevier
Published in:
Physics Letters B , Volume 809 C (2020)

Article ID: 135719
DOI:
https://doi.org/10.1016/j.physletb.2020.135719
Copyrights:
The Author(s)
Licence:
CC-BY-3.0

Fulltext files: