✦ LIBER ✦

Ab initio studies of the dipole polarizabilities of conjugated molecules: Part 2. Monocyclic azines

✍ Scribed by Alan Hinchliffe; Humberto J. Soscún M

Book ID: 114142277
Publisher: Elsevier Science
Year: 1994
Tongue: English
Weight: 870 KB
Volume: 304
Category: Article
ISSN: 0166-1280
DOI: 10.1016/s0166-1280(96)80003-0

No coin nor oath required. For personal study only.

📜 SIMILAR VOLUMES

Ab initio studies of the dipole polariza

Ab initio studies of the dipole polarizabilities of conjugated molecules Part 1. Ethene and benzene

✍ Alan Hinchliffe; Humberto J. Soscún M. 📂 Article 📅 1993 🏛 Elsevier Science 🌐 English ⚖ 549 KB

Ab initio studies of the dipole polariza

Ab initio studies of the dipole polarizabilities of conjugated molecules Part 4. The dipole polarizability and first hyperpolarizability of o-benzyne and related molecules

✍ Alan Hinchliffe; Humberto J. Soscún Machado 📂 Article 📅 1994 🏛 Elsevier Science 🌐 English ⚖ 562 KB

Ab initio studies of the dipole polariza

Ab initio studies of the dipole polarizabilities of conjugated molecules. Part 6. The geometry, static dipole polarizability and first hyperpolarizability of benzothiophene

✍ Alan Hinchliffe; Humberto J. Soscún Machado 📂 Article 📅 1995 🏛 Elsevier Science 🌐 English ⚖ 688 KB

Ab initio studies of the dipole polariza

Ab initio studies of the dipole polarizabilities of conjugated molecules: Part 3. One electron properties, dipole polarizability and first hyperpolarizability of quinoline and isoquinoline

✍ Alan Hinchliffe; Humberto J. Soscún Machado 📂 Article 📅 1994 🏛 Elsevier Science 🌐 English ⚖ 867 KB

Ab initio study of the static dipole pol

Ab initio study of the static dipole polarizability of naphthalene

✍ Alan Hinchliffe; Humberto J. Soscun Machado 📂 Article 📅 1993 🏛 Elsevier Science 🌐 English ⚖ 401 KB

An ab initio treatment of the molecular geometry and static dipole polarizability for naphthalene in its electronic ground state is reported, using the coupled perturbative Hartree-Fock method. It is shown that the 6-31 +G and the 6-311 +G basis sets both give polarizability values that are in excel

Ab initio study of the molecular electro

Ab initio study of the molecular electrostatic potential of monocyclic and bicyclic azines

✍ Humberto J. Soscun M; Yosslen Aray; Juan Murgich; Alan Hinchliffe 📂 Article 📅 1994 🏛 Elsevier Science 🌐 English ⚖ 597 KB