Lecture 11-Jack Simons Electronic Structure Theory- Density functional theory
ฝัง
- เผยแพร่เมื่อ 10 ก.พ. 2025
- Density functional theory fundamentals, strengths and weaknesses.
(1)Jack Simons Electronic Structure Theory- Session 1- Born-Oppenheimer approximation
• Lecture 01-Jack Simons...
(2)Jack Simons Electronic Structure Theory- Session 2- Hartree-Fock
• Lecture 02-Jack Simons...
(3)Jack Simons Electronic Structure Theory- Session 3- Dynamical pair correlations
• Lecture 03-Jack Simons...
(4)Jack Simons Electronic Structure Theory- Session 4- Linear combinations of atomic orbitals
• Lecture 04-Jack Simons...
(5)Jack Simons Electronic Structure Theory- Session 5- Basis sets
• Lecture 05-Jack Simons...
(6)Jack Simons Electronic Structure Theory- Session 6- Møller-Plesset perturbation theory
• Lecture 06-Jack Simons...
(7)Jack Simons Electronic Structure Theory- Session 7- Configuration interaction theory
• Lecture 07-Jack Simons...
(8)Jack Simons Electronic Structure Theory- Session 8- Coupled-cluster theory
• Lecture 08 -Jack Simon...
(9)Jack Simons Electronic Structure Theory- Session 9- Metastable anions
• Lecture 09-Jack Simons...
(10)Jack Simons Electronic Structure Theory- Session 10- Error trends
• Lecture 10-Jack Simons...
(11)Jack Simons Electronic Structure Theory- Session 11- Density functional theory
• Lecture 11-Jack Simons...
(12)Jack Simons Electronic Structure Theory- Session 12- Gradients and reaction paths
• Lecture 12-Jack Simons...
About Jack:
Jack Simons is Henry Erying Scientist and Professor of Chemistry at the University of Utah. He grew up in Girard, Ohio, earned his B. S. degree in chemistry at Case institute of Technology in 1967 and his Ph. D. in theoretical chemistry at the University of Wisconsin in 1970. After a postdoctoral year at MIT, he joined the Utah Chemistry faculty in 1971. Jack is the author of more than 320 papers, 5 textbooks, and several web sites on theory ( simons.hec.utah... ), and he has mentored more than 65 Ph. D. and postdoctoral students at Utah.
Perfect class, everything was very understandable.
Greatings from a spanish chemistry student.
plz sir make more video on semiemperical electronic structer theory
sir we are wating for your next lacture searise