An assessment of the structural resolution of various fingerprints commonly used in machine learning
Parsaeifard, Behnam, Sankar De, Deb, Christensen, Anders S, Faber, Felix A, Kocer, Emir, De, Sandip, Behler, Jörg, Anatole von Lilienfeld, O, Goedecker, Stefan
Published in Machine learning: science and technology (01.03.2021)
Published in Machine learning: science and technology (01.03.2021)
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Journal Article
Design of iso-material heterostructures of TiO2via seed mediated growth and arrested phase transitions
De, Deb Sankar, Behara, Dilip Kumar, Saha, Sulay, Kumar, Arun, Subramaniam, Anandh, Sivakumar, Sri, Pala, Raj Ganesh S
Published in Physical chemistry chemical physics : PCCP (01.01.2020)
Published in Physical chemistry chemical physics : PCCP (01.01.2020)
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Journal Article
Stable structures of exohedrally decorated C60-fullerenes
Sankar De, Deb, Flores-Livas, José A., Saha, Santanu, Genovese, Luigi, Goedecker, Stefan
Published in Carbon (New York) (01.04.2018)
Published in Carbon (New York) (01.04.2018)
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Journal Article
Design of iso-material heterostructures of TiO 2 via seed mediated growth and arrested phase transitions
De, Deb Sankar, Behara, Dilip Kumar, Saha, Sulay, Kumar, Arun, Subramaniam, Anandh, Sivakumar, Sri, Pala, Raj Ganesh S.
Published in Physical chemistry chemical physics : PCCP (11.11.2020)
Published in Physical chemistry chemical physics : PCCP (11.11.2020)
Get full text
Journal Article
Design of iso-material heterostructures of TiO seed mediated growth and arrested phase transitions
De, Deb Sankar, Behara, Dilip Kumar, Saha, Sulay, Kumar, Arun, Subramaniam, Anandh, Sivakumar, Sri, Pala, Raj Ganesh S
Published in Physical chemistry chemical physics : PCCP (11.11.2020)
Published in Physical chemistry chemical physics : PCCP (11.11.2020)
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Journal Article
Stable structures of exohedrally decorated C^sub 60^-fullerenes
De, Deb Sankar, Flores-Livas, José A, Saha, Santanu, Genovese, Luigi, Goedecker, Stefan
Published in Carbon (New York) (01.04.2018)
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Published in Carbon (New York) (01.04.2018)
Journal Article
Maximum volume simplex method for automatic selection and classification of atomic environments and environment descriptor compression
Parsaeifard, Behnam, Tomerini, Daniele, De, Deb Sankar, Goedecker, Stefan
Published in arXiv.org (14.09.2020)
Published in arXiv.org (14.09.2020)
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Paper
Journal Article
An assessment of the structural resolution of various fingerprints commonly used in machine learning
Parsaeifard, Behnam, De, Deb Sankar, Christensen, Anders S, Faber, Felix A, Kocer, Emir, De, Sandip, Behler, Joerg, Anatole von Lilienfeld, Goedecker, Stefan
Published in arXiv.org (07.08.2020)
Published in arXiv.org (07.08.2020)
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Paper
Journal Article
Comment on the stability of decorated C 48 B 12 heterofullerene
De, Deb Sankar, Saha, Santanu, Genovese, Luigi, Goedecker, Stefan
Published in arXiv.org (11.02.2018)
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Published in arXiv.org (11.02.2018)
Paper