Crystal structure of aqua­(citric acid)(hydrogen citrato)calcium monohydrate, [Ca(HC[subscript 6]H[subscript 5]O[subscript 7])(H[subscript 3]C[subscript 6]H[subscript 5]O[subscript 7])(H[subscript 2]O)]·H[subscript 2], from synchrotron X-ray powder data, and DFT-optimized crystal structure of existing calcium hydrogen citrate trihydrate, [Ca(HC[subscript 6]H[subscript 5]O[subscript 7])(H[subscript 2]O)[subscript 3]]

Kaduk, James A.

doi:10.1107/S2056989020012864

Title: Crystal structure of aqua(citric acid)(hydrogen citrato)calcium monohydrate, [Ca(HC[subscript 6]H[subscript 5]O[subscript 7])(H[subscript 3]C[subscript 6]H[subscript 5]O[subscript 7])(H[subscript 2]O)]·H[subscript 2], from synchrotron X-ray powder data, and DFT-optimized crystal structure of existing calcium hydrogen citrate trihydrate, [Ca(HC[subscript 6]H[subscript 5]O[subscript 7])(H[subscript 2]O)[subscript 3]]

Journal Article · Mon Jan 11 00:00:00 EST 2021 · Acta Crystallogr. E

DOI:https://doi.org/10.1107/S2056989020012864· OSTI ID:1759036

Kaduk, James A. ^[1]

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Research Organization:: Argonne National Lab. (ANL), Argonne, IL (United States). Advanced Photon Source (APS)

Sponsoring Organization:: DOE - BASIC ENERGY SCIENCES

OSTI ID:: 1759036

Journal Information:: Acta Crystallogr. E, Vol. 76, Issue (20) ; 10, 2020

Country of Publication:: United States

Language:: ENGLISH

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