Computational Chemistry 4.7 - Slater Determinants

Опубликовано: 24 Март 2018
на канале: TMP Chem
19,809
192

Short lecture on Slater determinants for N-electron wavefunctions.

Slater determinants are a formal mechanism to enforce the antisymmetry principle for an arbitrary N-electron wavefunction. Exchanging any pair of electrons results in an equivalent wavefunction with an opposite sign. A Slater determinant is a determinant of a matrix of all electrons (rows) and occupied spin orbitals (columns) in a molecular system. There is also a normalization constant of the inverse square root of N factorial, which is the number of all possible permutations of the spin orbitals (the number of ways of organizing N electrons in N spin orbitals [N! = N * N-1 * N-2 ... 1]. All determinants where all electrons are not in the same spin orbitals are orthogonal.

Notes Slide: https://i.imgur.com/peT1x21.png

-- About TMP Chem --

All TMP Chem content is free for everyone, everywhere, and created independently by Trent Parker.

Email: [email protected]

-- Video Links --

Course Playlist:    • Computational Chemistry  

Chapter Playlist:    • Hartree-Fock Theory  

Other Courses:    • PChem Course Intros  

Channel Info:    • About TMP Chem  

-- Social Links --

Facebook:   / tmpchem  

Twitter:   / tmpchem  

LinkedIn:   / tmpchem  

Imgur: https://tmpchem.imgur.com

GitHub: https://www.github.com/tmpchem

-- Equipment --

Microphone: Blue Yeti USB Microphone

Drawing Tablet: Wacom Intuos Pen and Touch Small

Drawing Program: Autodesk Sketchbook Express

Screen Capture: Corel Visual Studio Pro X8


Смотрите видео Computational Chemistry 4.7 - Slater Determinants онлайн без регистрации, длительностью часов минут секунд в хорошем качестве. Это видео добавил пользователь TMP Chem 24 Март 2018, не забудьте поделиться им ссылкой с друзьями и знакомыми, на нашем сайте его посмотрели 19,809 раз и оно понравилось 192 людям.