The individual and collective effects of exact exchange and dispersion interactions on the <i>ab initio</i> structure of liquid water
2014 · The Journal of Chemical Physics · 319 citations
https://doi.org/10.1063/1.4893377
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Biswajit Santra
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20
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Biswajit Santra is an academic researcher from Schrodinger (United States). The author has contributed to research in topics: Crystallization and Solubility Studies & X-ray Diffraction in Crystallography & Spectroscopy and Quantum Chemical Studies. The author has an h-index of 20, co-authored 110 publications.
ORCID: 0000-0003-3609-2106Papers by this author
worksA robust crystal structure prediction method to support small molecule drug development with large scale validation and blind study
2025 · Nature Communications · 15 citations
https://doi.org/10.1038/s41467-025-57479-1
Efficient Long-Range Machine Learning Force Fields for Liquid and Materials Properties
2025 · ArXiv.org · 2 citations
https://doi.org/10.48550/arxiv.2505.06462
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