š Ukuhlaziywa Kwemvelo (Uhlelo luka-2026ā2027)
Ukuhlaziywa Kwemvelo (Uhlelo luka-2026ā2027) yincwadi ephelele, egxile ocwaningweni eyenzelwe abafundi, othisha, kanye nabacwaningi bekhemistri, isayensi yezemvelo, ikhemistri yokuhlaziya, kanye nemikhakha ehlobene. Le ncwadi inikeza ukuqonda okujulile kwezimiso zekhemistri ye-quantum, izindlela zokubala, kanye namasu okuhlaziya okutadisha nokuqapha izinhlelo zezemvelo, ukungcola, kanye nezinqubo zamakhemikhali ezindaweni zemvelo nezakhiwo.
Ihlanganisa imiqondo eyisisekelo yemfundiso nezinhlelo zokusebenza ezisebenzayo, ivumela abafundi ukuthi baqonde izindlela zezinga lama-molecule, amandla okusabela, izindlela ze-spectroscopic, kanye nezindlela zokubala ekuhlaziyeni kwemvelo. Okuqukethwe kugcizelela imibono yezifundo ezahlukene, ukuxhumanisa ikhemistri, ifiziksi, imodeli yokubala, kanye nesayensi yezemvelo ukuze kuqashwe amakhemikhali ngendlela efanele kanye nokuxazulula izinkinga.
āļø Iyunithi 1: Isingeniso kanye Nezisekelo Zomlando ze-Quantum Chemistry
⢠Ububili be-Waveāparticle, i-de Broglie hypothesis, i-DavissonāGermer experiment
⢠Imikhawulo ye-physics yakudala kanye nokuvela kwe-quantum mechanics
⢠i-FranckāHertz experiment
⢠I-Ultraviolet catastrophe kanye ne-Planckās hypothesis
š¢ Iyunithi 2: Izisekelo Zezibalo
⢠I-algebra eqondile: ama-vector, ama-matrices, amasethi esisekelo
⢠Izilinganiso zomehluko kanye nezingxenye ezihlukile
⢠Izinhlaka ze-Fourier transforms kanye ne-vector calculus
⢠I-Dirac notation (i-bra-ket formalism)
⢠Ama-Commutators kanye nezakhiwo zawo ze-algebraic
š Iyunithi 3: Ama-Postulates e-Quantum Mechanics kanye ne-Schrƶdinger Equation
⢠Izilinganiso ze-Eigenvalue kanye nokubonwa ngokomzimba
⢠Ubuningi bamathuba kanye nomthamo wamanje
⢠Isimiso se-Superposition kanye nezimo ze-quantum
⢠Izimo ezimile kanye nokulinganisa amandla
š¹ Iyunithi 4: Izinhlelo Zemodeli Ezingaxazululeka Kahle
⢠Izingxenye ebhokisini (1D, 2D, 3D)
⢠I-rotor eqinile kanye ne-harmonic oscillator
⢠Ama-athomu e-hydrogen: amazinga wamandla kanye nama-athomu okujikeleza
⢠Ukwelashwa okuyisisekelo kwe-hydrogen molecule (Hā)
š Iyunithi 5: I-Angular Momentum kanye ne-Spin
⢠Imisebenzi ye-angular momentum kanye ne-spin ye-spin
⢠Ukwengezwa kwezinhlelo ze-angular momentum kanye ne-coupling
⢠Abaqhubi bezitebhisi kanye nesenzo sabo ezimweni ze-angular momentum
⢠I-athomu ephelele ye-angular kanye nezinombolo ze-quantum
⢠Ama-coefficients e-ClebschāGordan kanye ne-spināorbit coupling
ā” Iyunithi 6: Izindlela Zokulinganisa I: I-Variational Principle kanye ne-Perturbation Theory
⢠I-Variational theorem kanye ne-trial wave functions
⢠Izicelo ezinhlelweni ze-athomu kanye nama-molecule
⢠Ukukhetha imisebenzi yesilingo kanye namapharamitha e-variational
⢠I-HellmannāFeynman theorem
⢠Imikhawulo kanye nokusebenza kwe-perturbation theory
š§© Iyunithi 7: Ama-athomu amaningi e-Electron kanye ne-Electron Correlation
⢠Izincazelo ze-Pauli principle kanye ne-Slater
⢠Ukushintshana kwe-electron kanye ne-basic coordination
⢠Spin Ama-orbital kanye nokulwa nokulingana
⢠I-Fock operator kanye nokubaluleka kwayo ngokomzimba
⢠I-theorem kaKoopmans kanye namandla e-ionization
š¬ Iyunithi 8: I-Molecular Orbital Theory kanye ne-Valence Bond Theory
⢠Ukuqagela kwe-BornāOppenheimer
⢠Izisekelo ze-Valence-bond theory
⢠Ama-orbital ama-molecule asusiwe ezindaweni ezithile ezinhlelweni ezihlanganisiwe
⢠Ukuqhathanisa phakathi kwezindlela ze-MO kanye ne-VB zokubopha kwamakhemikhali
š Iyunithi 9: Izindlela ze-MO kanye ne-VB zezinhlelo ze-Polyatomic kanye ne-Ļ-Electron
⢠Ukwakhiwa kwe-polyatomic molecular orbital
⢠I-Huckel theory yezinhlelo ze-Ļ kanye ne-aromaticity
⢠Imibono ye-Delocalization kanye ne-conjugation
⢠Ukubopha ezinhlelweni ze-allyl kanye ne-butadiene
⢠Izibalo ze-Hückel molecular orbital (HMO)
š Iyunithi 10: Amasethi Esisekelo kanye Nokucatshangelwa Kwekhompyutha
⢠Izinhlobo zemisebenzi yesisekelo: Uhlobo lwe-Slater, uhlobo lwe-Gaussian
⢠Iphutha le-Basis set superposition (BSSE) kanye nokuphelela
⢠Izindlela zokuhlangana ze-RoothaanāHall, i-DIIS
⢠Amasethi esisekelo amancane, ahlukanisiwe, kanye ne-polarized
⢠Imisebenzi ye-Gaussian ehlanganisiwe kanye nokujwayelekile
āØLolu hlelo lokusebenza luphefumulelwe ababhali:
UDonald A. McQuarrie, u-Ira N. Levine, uPeter Atkins, uKlaus Ruedenberg, uLinus Pauling, uMark Tuckerman, uCharles Kittel
š² Landa i-Environmental Analysis (Uhlelo luka-2026ā2027) ukuze ube yingcweti ye-quantum chemistry, i-computational modeling, kanye nezindlela ze-spectroscopic zezinhlelo zemvelo. Ilungele abafundi, othisha, kanye nabacwaningi be-chemistry kanye nemikhakha yokuhlaziya
Kubuyekezwe ngo-
Feb 9, 2026