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Ab initio calculations of the electronic properties of new superconducting nanolaminates: Nb2SnC and Nb2SC1−x

✍ Scribed by I. R. Shein; V. G. Bamburov; A. L. Ivanovskii


Book ID
110160464
Publisher
SP MAIK Nauka/Interperiodica
Year
2006
Tongue
English
Weight
189 KB
Volume
411
Category
Article
ISSN
0012-5016

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Ab initio calculations of the properties
✍ M. Fehér; P.A. Martin 📂 Article 📅 1993 🏛 Elsevier Science 🌐 English ⚖ 428 KB

The potential energy curves, dipole, quadrupole, octopole and hexadecapole moment functions of the ground X 'Z+ state of NO+ have been calculated at Hartree-Fock, CASSCF, MR-CI and MP2 levels using a [ Ss6p3d] basis set In addition, dipole polansablhtles have also been calculated at the HF and MP2 l