Matches in SemOpenAlex for { <https://semopenalex.org/work/W3136565593> ?p ?o ?g. }
- W3136565593 abstract "Abstract Crystal agglomeration is an important factor that can affect the purity and crystal habit of crystalline products. Agglomeration of niacin crystals in its cooling crystallization and its mechanism is investigated using both experimental and molecular dynamics simulation methods. The magnitude of the interaction energy which is mainly contributed by the hydrogen bond and π–π stacking between the (0 1 1) crystal face and (1 1 −1) crystal face that have both the pyridine and carboxyl groups is the main factor determining the extent of agglomeration of niacin crystal. Besides, the interaction energy increases with the crystallization temperature and the supersaturation of the solution, and hence the agglomeration is more severe. The change of solvent species has minimal effect on the agglomeration of crystals. Besides, the agglomeration situation of carbamazepine and acetaminophen that with similar structures to niacin is also verified using molecular dynamics simulations. The findings in this work can be used to predict, control the agglomeration phenomenon, and optimize the crystallization process of niacin and other substances with similar chemical structure." @default.
- W3136565593 created "2021-03-29" @default.
- W3136565593 creator A5064482773 @default.
- W3136565593 creator A5073216396 @default.
- W3136565593 date "2021-03-22" @default.
- W3136565593 modified "2023-10-17" @default.
- W3136565593 title "The Agglomeration of Niacin Crystals in the Cooling Crystallization Process" @default.
- W3136565593 cites W1463921796 @default.
- W3136565593 cites W1967068504 @default.
- W3136565593 cites W1968339413 @default.
- W3136565593 cites W1969334624 @default.
- W3136565593 cites W1970298607 @default.
- W3136565593 cites W1973751855 @default.
- W3136565593 cites W1991874520 @default.
- W3136565593 cites W1993370512 @default.
- W3136565593 cites W1999594202 @default.
- W3136565593 cites W2022539781 @default.
- W3136565593 cites W2026126644 @default.
- W3136565593 cites W2026448047 @default.
- W3136565593 cites W2046281948 @default.
- W3136565593 cites W2046589940 @default.
- W3136565593 cites W2058774104 @default.
- W3136565593 cites W2059533892 @default.
- W3136565593 cites W2066605607 @default.
- W3136565593 cites W2086626740 @default.
- W3136565593 cites W2090433309 @default.
- W3136565593 cites W2096737667 @default.
- W3136565593 cites W2100212827 @default.
- W3136565593 cites W2136559250 @default.
- W3136565593 cites W2147142587 @default.
- W3136565593 cites W2155273425 @default.
- W3136565593 cites W2161365539 @default.
- W3136565593 cites W2229764831 @default.
- W3136565593 cites W2475385728 @default.
- W3136565593 cites W2503198117 @default.
- W3136565593 cites W2586584545 @default.
- W3136565593 cites W2737178809 @default.
- W3136565593 cites W2972159093 @default.
- W3136565593 cites W2988722693 @default.
- W3136565593 cites W2999511382 @default.
- W3136565593 cites W3000616167 @default.
- W3136565593 cites W3004239554 @default.
- W3136565593 cites W44329909 @default.
- W3136565593 doi "https://doi.org/10.1002/crat.202000209" @default.
- W3136565593 hasPublicationYear "2021" @default.
- W3136565593 type Work @default.
- W3136565593 sameAs 3136565593 @default.
- W3136565593 citedByCount "2" @default.
- W3136565593 countsByYear W31365655932023 @default.
- W3136565593 crossrefType "journal-article" @default.
- W3136565593 hasAuthorship W3136565593A5064482773 @default.
- W3136565593 hasAuthorship W3136565593A5073216396 @default.
- W3136565593 hasConcept C112887158 @default.
- W3136565593 hasConcept C127413603 @default.
- W3136565593 hasConcept C131850264 @default.
- W3136565593 hasConcept C159467904 @default.
- W3136565593 hasConcept C178790620 @default.
- W3136565593 hasConcept C185592680 @default.
- W3136565593 hasConcept C192562407 @default.
- W3136565593 hasConcept C199360897 @default.
- W3136565593 hasConcept C200447597 @default.
- W3136565593 hasConcept C203036418 @default.
- W3136565593 hasConcept C26456737 @default.
- W3136565593 hasConcept C2780092750 @default.
- W3136565593 hasConcept C2781285689 @default.
- W3136565593 hasConcept C32909587 @default.
- W3136565593 hasConcept C41008148 @default.
- W3136565593 hasConcept C42360764 @default.
- W3136565593 hasConcept C55493867 @default.
- W3136565593 hasConcept C8010536 @default.
- W3136565593 hasConceptScore W3136565593C112887158 @default.
- W3136565593 hasConceptScore W3136565593C127413603 @default.
- W3136565593 hasConceptScore W3136565593C131850264 @default.
- W3136565593 hasConceptScore W3136565593C159467904 @default.
- W3136565593 hasConceptScore W3136565593C178790620 @default.
- W3136565593 hasConceptScore W3136565593C185592680 @default.
- W3136565593 hasConceptScore W3136565593C192562407 @default.
- W3136565593 hasConceptScore W3136565593C199360897 @default.
- W3136565593 hasConceptScore W3136565593C200447597 @default.
- W3136565593 hasConceptScore W3136565593C203036418 @default.
- W3136565593 hasConceptScore W3136565593C26456737 @default.
- W3136565593 hasConceptScore W3136565593C2780092750 @default.
- W3136565593 hasConceptScore W3136565593C2781285689 @default.
- W3136565593 hasConceptScore W3136565593C32909587 @default.
- W3136565593 hasConceptScore W3136565593C41008148 @default.
- W3136565593 hasConceptScore W3136565593C42360764 @default.
- W3136565593 hasConceptScore W3136565593C55493867 @default.
- W3136565593 hasConceptScore W3136565593C8010536 @default.
- W3136565593 hasFunder F4320321001 @default.
- W3136565593 hasIssue "6" @default.
- W3136565593 hasLocation W31365655931 @default.
- W3136565593 hasOpenAccess W3136565593 @default.
- W3136565593 hasPrimaryLocation W31365655931 @default.
- W3136565593 hasRelatedWork W160349064 @default.
- W3136565593 hasRelatedWork W1965802180 @default.
- W3136565593 hasRelatedWork W1995227417 @default.
- W3136565593 hasRelatedWork W2019135455 @default.
- W3136565593 hasRelatedWork W2038392859 @default.
- W3136565593 hasRelatedWork W2135214430 @default.
- W3136565593 hasRelatedWork W2372266576 @default.