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Inclusion of relativistic effects in Gaussian-basis density functional calculations for extended systems

✍ Scribed by J.C Boettger; S.B Trickey

No coin nor oath required. For personal study only.

📜 SIMILAR VOLUMES

Perturbative relativistic calculations f

✍ Robert Franke; Werner Kutzelnigg 📂 Article 📅 1992 🏛 Elsevier Science 🌐 English ⚖ 508 KB

Gaussian basis sets for calculation of s

✍ Daniel M. Chipman 📂 Article 📅 1989 🏛 Springer 🌐 English ⚖ 788 KB

Density functional calculations of molec

✍ van Lenthe, Erik; van der Avoird, Ad; Wormer, Paul E. S. 📂 Article 📅 1998 🏛 American Institute of Physics 🌐 English ⚖ 435 KB

Extended floating spherical Gaussian bas

✍ Ludwik Adamowicz; Rodney J. Bartlett 📂 Article 📅 1984 🏛 Elsevier Science 🌐 English ⚖ 382 KB

Density functional calculations of nucle

✍ van Lenthe, Erik; Jan Baerends, Evert 📂 Article 📅 2000 🏛 American Institute of Physics 🌐 English ⚖ 392 KB

Optimization of Gaussian-type basis sets

✍ Godbout, Nathalie; Salahub, Dennis R.; Andzelm, Jan; Wimmer, Erich 📂 Article 📅 1992 🏛 NRC Research Press 🌐 French ⚖ 816 KB