Vote for your favorite mineral in #MinCup25! - Baryte vs. Hematite
It's a heavyweight match between industrial powerhouses as soft #baryte competes against rusty red #hematite.
Log InRegister
Quick Links : The Mindat ManualThe Rock H. Currier Digital LibraryMindat Newsletter [Free Download]
Home PageAbout MindatThe Mindat ManualHistory of MindatCopyright StatusWho We AreContact UsAdvertise on Mindat
Donate to MindatCorporate SponsorshipSponsor a PageSponsored PagesMindat AdvertisersAdvertise on Mindat
Learning CenterWhat is a mineral?The most common minerals on earthInformation for EducatorsMindat ArticlesThe ElementsThe Rock H. Currier Digital LibraryGeologic Time
Minerals by PropertiesMinerals by ChemistryAdvanced Locality SearchRandom MineralRandom LocalitySearch by minIDLocalities Near MeSearch ArticlesSearch GlossaryMore Search Options
Search For:
Mineral Name:
Locality Name:
Keyword(s):
 
The Mindat ManualAdd a New PhotoRate PhotosLocality Edit ReportCoordinate Completion ReportAdd Glossary Item
Mining CompaniesStatisticsUsersMineral MuseumsClubs & OrganizationsMineral Shows & EventsThe Mindat DirectoryDevice SettingsThe Mineral Quiz
Photo SearchPhoto GalleriesSearch by ColorNew Photos TodayNew Photos YesterdayMembers' Photo GalleriesPast Photo of the Day GalleryPhotography

Hatzipanayioti, Despina, Tzeferakos, George, Petropouleas, Panayiotis (2008) DFT and experimental investigation of catecholate derivatives of benzoic acid and pyridine. Chemical Physics, 345. 119-129 doi:10.1016/j.chemphys.2008.02.003

Advanced
   -   Only viewable:
Reference TypeJournal (article/letter/editorial)
TitleDFT and experimental investigation of catecholate derivatives of benzoic acid and pyridine
JournalChemical Physics
AuthorsHatzipanayioti, DespinaAuthor
Tzeferakos, GeorgeAuthor
Petropouleas, PanayiotisAuthor
Year2008 (April)Volume345
PublisherElsevier BV
DOIdoi:10.1016/j.chemphys.2008.02.003Search in ResearchGate
Generate Citation Formats
Mindat Ref. ID5961470Long-form Identifiermindat:1:5:5961470:8
GUID0
Full ReferenceHatzipanayioti, Despina, Tzeferakos, George, Petropouleas, Panayiotis (2008) DFT and experimental investigation of catecholate derivatives of benzoic acid and pyridine. Chemical Physics, 345. 119-129 doi:10.1016/j.chemphys.2008.02.003
Plain TextHatzipanayioti, Despina, Tzeferakos, George, Petropouleas, Panayiotis (2008) DFT and experimental investigation of catecholate derivatives of benzoic acid and pyridine. Chemical Physics, 345. 119-129 doi:10.1016/j.chemphys.2008.02.003
In(n.d.) Chemical Physics Vol. 345. Elsevier BV

See Also

These are possibly similar items as determined by title/reference text matching only.

Hatzipanayioti, Despina, Karaliota, Alexandra, Kamariotaki, Mary, Aletras, Vasilios, Petropouleas, Panayiotis (2006) Theoretical and spectroscopic investigation of the oxidation and degradation of protocatechuic acid. Chemical Physics, 325. 341-350 doi:10.1016/j.chemphys.2005.12.029
Pavlos, Dimitrios, Petropouleas, Panayiotis, Hatzipanayioti, Despina (2015) Theoretical and experimental investigation of carnosine and its oxygenated adducts. The reaction with the nickel ion. Chemical Physics, 461. 63-73 doi:10.1016/j.chemphys.2015.08.027
Petropouleas, Panayiotis, Koufopoulos, George, Hatzipanayioti, Despina (2012) Theoretical and experimental investigation of the oxidized and oxygenated forms of pyrocatechuic acid (2,3-dihydroxybenzoic acid) Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 94. 169-179 doi:10.1016/j.saa.2012.03.060
Hatzipanayioti, Despina, Petropouleas, Panayiotis (2010) Theoretical and experimental investigation of the semiquinone forms of protocatechuic acid. The effect of manganese. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 75 (3) 997-1007 doi:10.1016/j.saa.2009.12.025
Hatzipanayioti, Despina, Kontotheodorou, Konstantinos (2011) The chemistry and preparation of tantalum complexes with 2,3-dihydroxy benzoic acid: Experimental and theoretical investigation. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 78 (3) 949-960 doi:10.1016/j.saa.2010.11.049
Wang, Li-Ran, Fang, Yan (2006) Experimental (UV-Raman) and theoretical (DFT) study of pyridine carboxylic acid in aqueous solution. Chemical Physics, 323. 376-382 doi:10.1016/j.chemphys.2005.10.001
Buemi, Giuseppe, Zuccarello, Felice (2004) DFT study of the intramolecular hydrogen bonds in the amino and nitro-derivatives of malonaldehyde. Chemical Physics, 306. 115-129 doi:10.1016/j.chemphys.2004.07.020
Manopradha, N., Gowri, S., Selvaraju, K., Kirubavathi, K. (2024) Experimental and quantum computational studies of benzotriazole pyridine-2-carboxylic acid crystals. Chemical Physics, 585. 112368 doi:10.1016/j.chemphys.2024.112368
Amat, Anna, De Angelis, Filippo, Sgamellotti, Antonio, Fantacci, Simona (2008) Acid–base chemistry of luteolin and its methyl-ether derivatives: A DFT and ab initio investigation. Chemical Physics Letters, 462. 313-317 doi:10.1016/j.cplett.2008.07.098
Tekin, Nalan, Cebe, Mustafa, Tarımcı, Çelik (2004) Polarizabilities and dipole moments of benzaldehyde, benzoic acid and oxalic acid in polar and nonpolar solvents. Chemical Physics, 300. 239-246 doi:10.1016/j.chemphys.2004.01.022
Chetri, Pawan, Basyach, Priyanka, Choudhury, Amarjyoti (2014) Structural, optical and photocatalytic properties of TiO2/SnO2 and SnO2/TiO2 core–shell nanocomposites: An experimental and DFT investigation. Chemical Physics, 434. 1-10 doi:10.1016/j.chemphys.2014.02.007
 
and/or  
Mindat.org is an outreach project of the Hudson Institute of Mineralogy, a 501(c)(3) not-for-profit organization.
Copyright © mindat.org and the Hudson Institute of Mineralogy 1993-2025, except where stated. Most political location boundaries are © OpenStreetMap contributors. Mindat.org relies on the contributions of thousands of members and supporters. Founded in 2000 by Jolyon Ralph.
To cite: Ralph, J., Von Bargen, D., Martynov, P., Zhang, J., Que, X., Prabhu, A., Morrison, S. M., Li, W., Chen, W., & Ma, X. (2025). Mindat.org: The open access mineralogy database to accelerate data-intensive geoscience research. American Mineralogist, 110(6), 833–844. doi:10.2138/am-2024-9486.
Privacy Policy - Terms & Conditions - Contact Us / DMCA issues - Report a bug/vulnerability Current server date and time: September 19, 2025 10:32:33
Go to top of page