Analytic Boundary Terms for Arbitrary Crystal Geometries and Direct-Sum Evaluation of Madelung Constants in Triclinic Lattices

Yang He, Zhonghan Hu

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DOI: 10.1021/acs.jctc.6c01289
Published: 2026-08-13
Container: Journal of Chemical Theory and Computation
Publisher: American Chemical Society (ACS)
Open access: unknown

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Cite this work

BibTeX

@article{allodium:10.1021/acs.jctc.6c01289,
  title = {Analytic Boundary
Terms for Arbitrary Crystal Geometries
and Direct-Sum Evaluation of Madelung Constants in Triclinic Lattices},
  author = {Yang He and Zhonghan Hu},
  year = {2026},
  journal = {Journal of Chemical Theory
and Computation},
  doi = {10.1021/acs.jctc.6c01289},
  url = {https://doi.org/10.1021/acs.jctc.6c01289}
}

RIS

TY  - JOUR
TI  - Analytic Boundary
Terms for Arbitrary Crystal Geometries
and Direct-Sum Evaluation of Madelung Constants in Triclinic Lattices
AU  - Yang He
AU  - Zhonghan Hu
PY  - 2026
JO  - Journal of Chemical Theory
and Computation
DO  - 10.1021/acs.jctc.6c01289
UR  - https://doi.org/10.1021/acs.jctc.6c01289
ER  -

APA

He, Y., & Hu, Z. (2026). Analytic Boundary Terms for Arbitrary Crystal Geometries and Direct-Sum Evaluation of Madelung Constants in Triclinic Lattices. Journal of Chemical Theory and Computation. https://doi.org/10.1021/acs.jctc.6c01289

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crossref · retrieved 2026-11-10T19:51:06.048Z