Vote for your favorite mineral in #MinCup25! - Titanite vs. Thortveitite
It's a pair of T-minerals with as versatile #titanite faces off against the home of rare earth elements #thortveitite.
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

Hashimoto, Kenro, Morokuma, Keiji (1995) Ab Initio MO Study of Na(NH3)n (n = 1-6) Clusters and Their Ions: A Systematic Comparison with Hydrated Na Clusters. Journal Of The American Chemical Society, 117 (14) 4151-4159 doi:10.1021/ja00119a032

Advanced
   -   Only viewable:
Reference TypeJournal (article/letter/editorial)
TitleAb Initio MO Study of Na(NH3)n (n = 1-6) Clusters and Their Ions: A Systematic Comparison with Hydrated Na Clusters
JournalJournal Of The American Chemical Society
AuthorsHashimoto, KenroAuthor
Morokuma, KeijiAuthor
Year1995 (April)Volume117
Issue14
PublisherAmerican Chemical Society (ACS)
DOIdoi:10.1021/ja00119a032Search in ResearchGate
Generate Citation Formats
Mindat Ref. ID1489350Long-form Identifiermindat:1:5:1489350:8
GUID0
Full ReferenceHashimoto, Kenro, Morokuma, Keiji (1995) Ab Initio MO Study of Na(NH3)n (n = 1-6) Clusters and Their Ions: A Systematic Comparison with Hydrated Na Clusters. Journal Of The American Chemical Society, 117 (14) 4151-4159 doi:10.1021/ja00119a032
Plain TextHashimoto, Kenro, Morokuma, Keiji (1995) Ab Initio MO Study of Na(NH3)n (n = 1-6) Clusters and Their Ions: A Systematic Comparison with Hydrated Na Clusters. Journal Of The American Chemical Society, 117 (14) 4151-4159 doi:10.1021/ja00119a032
In(1995, April) Journal Of The American Chemical Society Vol. 117 (14) American Chemical Society (ACS)

See Also

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

Hashimoto, Kenro, Morokuma, Keiji (1994) Ab Initio Molecular Orbital Study of Na(H2O)n (n = 1-6) Clusters and Their Ions. Comparison of Electronic Structure of the "Surface" and "Interior" Complexes. Journal Of The American Chemical Society, 116 (25) 11436-11443 doi:10.1021/ja00104a024
Hashimoto, Kenro, He, Shaoren, Morokuma, Keiji (1993) Structures, stabilities and ionization potentials of Na(H2O) n and Na(NH3)n (n= 1–6) clusters. An ab initio MO study. Chemical Physics Letters, 206. 297-304 doi:10.1016/0009-2614(93)85555-3
Hashimoto, Kenro, Kamimoto, Tetsuya, Fuke, Kiyokazu (1997) Ab initio MO study of solvated negative alkali atom clusters: [M(H2O) ]− and [M(NH3) ]− (M  Na and Li, n = 1−3). Chemical Physics Letters, 266. 7-15 doi:10.1016/s0009-2614(96)01502-3
Hashimoto, Kenro, Daigoku, Kota (2009) Formation and localization of a solvated electron in ground and low-lying excited states of Li(NH3)n and Li(H2O)n clusters: a comparison with Na(NH3)n and Na(H2O)n. Physical Chemistry Chemical Physics, 11 (41). 9391pp. doi:10.1039/b907766a
Ohta, Katsuhisa., Morokuma, Keiji. (1987) An ab initio MO study on electron transfer in gas-phase hydrated clusters: O2-(H2O)n + O2 .fwdarw. O2 + O2-(H2O)n (n = 0, 1, and 2). The Journal of Physical Chemistry, 91 (2). 401-406 doi:10.1021/j100286a030
Hashimoto, Kenro, Morokuma, Keiji (1994) Ab initio theoretical study of ‘surface’ and ‘interior’ structures of the Na (H2O)4 cluster and its cation. Chemical Physics Letters, 223. 423-430 doi:10.1016/0009-2614(94)00489-7
Hashimoto, Kenro, Daigoku, Kota (2009) Ground and low-lying excited states of Na(NH3)n and Na(H2O)n clusters: Formation and localization of solvated electron. Chemical Physics Letters, 469. 62-67 doi:10.1016/j.cplett.2008.12.079
Takasu, Ryozo, Hashimoto, Kenro, Okuda, Rei, Fuke, Kiyokazu (1999) Solvation of Sodium Dimer in Ammonia Clusters:  Photoelectron Spectroscopy and ab Initio Study of Na2-(NH3)n. The Journal of Physical Chemistry A, 103 (3). 349-354 doi:10.1021/jp9832948
Mebel, Alexander M., Morokuma, Keiji, Musaev, Djamaladdin G. (1994) Ab Initio MO Study of Cluster Rearrangements in Pentagonal Pyramidal Clusters: B6H10 Borane and [(IrB5H8)(CO)(PH3)2] Metallaborane. Journal Of The American Chemical Society, 116 (9) 3932-3942 doi:10.1021/ja00088a032
Hashimoto, Kenro, Kamimoto, Tetsuya, Daigoku, Kota (2000) Theoretical Study of [Na(H2O)n]-(n= 1−4) Clusters:  Geometries, Vertical Detachment Energies, and IR Spectra. The Journal of Physical Chemistry A, 104 (15). 3299-3307 doi:10.1021/jp992525n
Nagase, Shigeru, Ray, N. K., Morokuma, Keiji (1980) Reaction mechanism of hydroboration. Ab initio MO study on the C2H4 + BH3 reaction. Journal Of The American Chemical Society, 102 (13) 4536-4537 doi:10.1021/ja00533a048
 
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 11, 2025 23:15:53
Go to top of page