Electronegativity, Charge Transfer, Crystal Field Strength, and the Point Charge Model Revisited (Unbekannt)
- Neue Suche nach: Tanner, Peter A.
- Neue Suche nach: Ning, Lixin
- Neue Suche nach: Tanner, Peter A.
- Neue Suche nach: Ning, Lixin
In:
The Journal of Physical
Chemistry A
;
117
, 7
;
1503-1507
;
2013
- Aufsatz (Zeitschrift) / Elektronische Ressource
-
Titel:Electronegativity, Charge Transfer, Crystal Field Strength, and the Point Charge Model Revisited
-
Weitere Titelangaben:J. Phys. Chem. A
-
Beteiligte:Tanner, Peter A. ( Autor:in ) / Ning, Lixin ( Autor:in )
-
Erschienen in:The Journal of Physical Chemistry A ; 117, 7 ; 1503-1507
-
Verlag:
- Neue Suche nach: American Chemical Society
-
Erscheinungsdatum:21.02.2013
-
ISSN:
-
Coden:
-
DOI:
-
Medientyp:Aufsatz (Zeitschrift)
-
Format:Elektronische Ressource
-
Sprache:Unbekannt
-
Datenquelle:
Inhaltsverzeichnis – Band 117, Ausgabe 7
Zeige alle Jahrgänge und Ausgaben
Die Inhaltsverzeichnisse werden automatisch erzeugt und basieren auf den im Index des TIB-Portals verfügbaren Einzelnachweisen der enthaltenen Beiträge. Die Anzeige der Inhaltsverzeichnisse kann daher unvollständig oder lückenhaft sein.
- 1371
-
Shock Tube and Chemical Kinetic Modeling Study of the Oxidation of 2,5-DimethylfuranSirjean, Baptiste / Fournet, René / Glaude, Pierre-Alexandre / Battin-Leclerc, Frédérique / Wang, Weijing / Oehlschlaeger, Matthew A. et al. | 2013
- 1393
-
Coulomb Explosion of Dichloroethene Geometric Isomers at 1 PW cm–2Yatsuhashi, Tomoyuki / Nakashima, Nobuaki / Azuma, Juri et al. | 2013
- 1400
-
Active Role of Proton in Excited State Intramolecular Proton Transfer ReactionLee, Junghwa / Kim, Chul Hoon / Joo, Taiha et al. | 2013
- 1406
-
Accurate Study on the Quantum Dynamics of the He + HeH^+ (X^1 Sigma ^+) Reaction on A New ab Initio Potential Energy Surface for the Lowest 1^1A' Electronic Singlet StateXu, W. / Zhang, P. et al. | 2013
- 1406
-
Accurate Study on the Quantum Dynamics of the He + HeH+ (X1Σ+) Reaction on A New ab Initio Potential Energy Surface for the Lowest 11A′ Electronic Singlet StateXu, Wenwu / Zhang, Peiyu et al. | 2013
- 1413
-
Optical and Time-Resolved Electron Paramagnetic Resonance Studies of the Excited States of a UV‑B Absorber (4-Methylbenzylidene)camphorKikuchi, Azusa / Shibata, Kenji / Kumasaka, Ryo / Yagi, Mikio et al. | 2013
- 1420
-
Analysis of Low-Lying Gerade Rydberg States of Acetylene Using Two-Photon Resonance Fluorescence Excitation SpectroscopyTsuji, Kazuhide / Misawa, Kentaro / Awamura, Junichi / Kawai, Akio / Shibuya, Kazuhiko et al. | 2013
- 1428
-
Excimer of 9‑Aminoacridine Hydrochloride Hydrate in Confined Medium: An Integrated Experimental and Theoretical StudyMitra, Piyali / Chakraborty, Brotati / Bhattacharyya, Dhananjay / Basu, Samita et al. | 2013
- 1439
-
Monotrimethylene-Bridged Bis‑p‑phenylenediamine Radical Cations and Dications: Spin States, Conformations, and DynamicsZalibera, Michal / Jalilov, Almaz S. / Stoll, Stefan / Guzei, Ilia A. / Gescheidt, Georg / Nelsen, Stephen F. et al. | 2013
- 1449
-
Energetics and Dynamics of the Low-Lying Electronic States of Constrained Polyenes: Implications for Infinite PolyenesChristensen, Ronald L. / Enriquez, Miriam M. / Wagner, Nicole L. / Peacock-Villada, Alexandra Y. / Scriban, Corina / Schrock, Richard R. / Polívka, Tomáš / Frank, Harry A. / Birge, Robert R. et al. | 2013
- 1466
-
Determination of Very Rapid Molecular Rotation by Using the Central Electron Paramagnetic Resonance LineKurban, Mark R. et al. | 2013
- 1474
-
Mechanism for Different Fluorescence Response of a Coumarin–Amide–Dipicolylamine Linkage to Zn(II) and Cd(II) in WaterSumiya, Shigehiro / Shiraishi, Yasuhiro / Hirai, Takayuki et al. | 2013
- 1483
-
Influence of Intense THz Radiation on Spin State of Photoswitchable Compound Cu(hfac)2LPrVeber, Sergey L. / Fedin, Matvey V. / Maryunina, Ksenia Yu. / Boldyrev, Kirill N. / Sheglov, Mikhail A. / Kubarev, Vitaly V. / Shevchenko, Oleg A. / Vinokurov, Nikolay A. / Kulipanov, Gennady N. / Sagdeev, Renad Z. et al. | 2013
- 1492
-
Visible Light-Driven Chemistry of Oxalic Acid in Solid Argon, Probed by Raman SpectroscopyOlbert-Majkut, Adriana / Ahokas, Jussi / Pettersson, Mika / Lundell, Jan et al. | 2013
- 1503
-
Electronegativity, Charge Transfer, Crystal Field Strength, and the Point Charge Model RevisitedTanner, Peter A. / Ning, Lixin et al. | 2013
- 1508
-
Infrared Spectra of NgBeS (Ng = Ne, Ar, Kr, Xe) and BeS2 in Noble-Gas MatricesWang, Qiang / Wang, Xuefeng et al. | 2013
- 1514
-
Carbonyl Bonding on Oxophilic Metal Centers: Infrared Photodissociation Spectroscopy of Mononuclear and Dinuclear Titanium Carbonyl Cation ComplexesZhou, Xiaojie / Cui, Jieming / Li, Zhen Hua / Wang, Guanjun / Liu, Zhipan / Zhou, Mingfei et al. | 2013
- 1522
-
Ground State Proton Transfer in Phenol-(NH~3)~n (nMiyazaki, M. / Kawanishi, A. / Nielsen, I. / Alata, I. / Ishiuchi, S.-i. / Dedonder, C. / Jouvet, C. / Fujii, M. et al. | 2013
- 1522
-
Ground State Proton Transfer in Phenol–(NH3) n (n ≤ 11) Clusters Studied by Mid-IR Spectroscopy in 3–10 μm RangeMiyazaki, Mitsuhiko / Kawanishi, Ayako / Nielsen, Iben / Alata, Ivan / Ishiuchi, Shun-ichi / Dedonder, Claude / Jouvet, Christophe / Fujii, Masaaki et al. | 2013
- 1531
-
Theoretical Investigation on Monomer and Solvent Selection for Molecular Imprinting of NitrocompoundsSaloni, Julia / Walker, Kiara / Hill, Glake et al. | 2013
- 1535
-
Transferability of Atomic Multipoles in Amino Acids and Peptides for Various Density PartitionsWoińska, Magdalena / Dominiak, Paulina M. et al. | 2013
- 1548
-
Quantum-Chemical Studies on the Favored and Rare Tautomers of Neutral and Redox AdenineRaczyńska, Ewa D. / Makowski, Mariusz / Zientara-Rytter, Katarzyna / Kolczyńska, Katarzyna / Stępniewski, Tomasz M. / Hallmann, Małgorzata et al. | 2013
- 1560
-
Impact of Geometry Optimization on Base–Base Stacking Interaction Energies in the Canonical A- and B‑Forms of DNAMcDonald, Ashley Ringer / Denning, Elizabeth J. / MacKerell, Alexander D. et al. | 2013
- 1569
-
Ab Initio Calculations of Thermochemical Properties of Methanol ClustersUmer, Muhammad / Leonhard, Kai et al. | 2013
- 1583
-
Structures, Stabilization Energies, and Binding Energies of Quinoxaline···(H2O) n , Quinoxaline Dimer, and Quinoxaline···Cu Complexes: A Theoretical StudyKabanda, Mwadham M. / Ebenso, Eno E. et al. | 2013
- 1596
-
Reactivity Patterns of Imidazole, Oxazole, and Thiazole As Reflected by the Polarization Justified Fukui FunctionsBeker, Wiktor / Szarek, Paweł / Komorowski, Ludwik / Lipiński, Józef et al. | 2013
- 1601
-
Interaction Between Group IIb Divalent Transition-Metal Cations and 3‑Mercaptopropionic Acid: A Computational and Topological PerspectiveBagchi, Sabyasachi / Mandal, Debasish / Ghosh, Deepanwita / Das, Abhijit K. et al. | 2013
- 1614
-
Planar to 3D Transition in the B6H y AnionsOlson, J. K. / Boldyrev, A. I. et al. | 2013
- 1621
-
Pseudo Jahn–Teller Effect and Natural Bond Orbital Analysis of Structural Properties of Tetrahydridodimetallenes M2H4, (M = Si, Ge, and Sn)Nori-Shargh, Davood / Mousavi, Seiedeh Negar / Boggs, James E. et al. | 2013
- 1632
-
Bonded Radii and the Contraction of the Electron Density of the Oxygen Atom by Bonded InteractionsGibbs, Gerald V. / Ross, Nancy L. / Cox, David F. / Rosso, Kevin M. / Iversen, Bo B. / Spackman, Mark A. et al. | 2013
- 1641
-
Anomeric Effect in Halogenated Methanols: A Quantum Theory of Atoms in Molecules StudyFerro-Costas, David / Vila, Antonio / Mosquera, Ricardo A. et al. | 2013
- 1651
-
Tautomerism and Possible Polymorphism in Solid Hydroxypyridines and Pyridones Studied by 14N NQRSeliger, Janez / Žagar, Veselko et al. | 2013
- 1659
-
Conformational Analysis and Intramolecular Interactions in Aminofluorobenzoic AcidsSilla, Josué M. / Cormanich, Rodrigo A. / Rittner, Roberto / Freitas, Matheus P. et al. | 2013
- 1665
-
Luminescence of BODIPY and Dipyrrin: An MCSCF Comparison of Excited StatesBuyuktemiz, Muhammed / Duman, Selin / Dede, Yavuz et al. | 2013
- 1670
-
A New Generation of B n N n Rings as a Supplement to Boron Nitride Tubes and CagesMonajjemi, Majid / Boggs, James E. et al. | 2013