Quantum Guru Ji

Quantum Guru Ji

@quantumguruji
This channel focus on tutorials related to molecular simulations based on Gaussian and materials simulations based on the material studio.
Gaussian and MATERIALS STUDIO are software packages widely used in computational chemistry and materials science.

Gaussian is a popular computational chemistry software that uses various quantum mechanical methods, such as density functional theory (DFT) and Hartree-Fock, to study the properties of molecules and solids. It can be used for geometry optimization, frequency calculations, and HOMO-LUMO calculations.

MATERIALS STUDIO is a software package developed by Accelrys (now part of Biovia) that provides a wide range of materials modeling and simulation tools. It includes modules for quantum mechanics, molecular dynamics, and classical mechanics simulations, as well as databases of materials properties and tools for visualizing and analyzing simulation results.
17:07
How to design AA.., AB.., ABC.., Stacking
2 years ago
4:38
How to design Single and Multi-Wall Nanotube
2 years ago
11:12
How to design Nanorope and Nanoribbon
2 years ago
5:57
Quickly design any materials in the materials studio
2 years ago
7:26
Optical Properties Calculations
2 years ago
3:53
Scanning Tunneling Microscopy (STM) Profile
2 years ago
8:22
IIT Without JEE ?? || बिना JEE qualify किए IIT में कैसे पढ़ाई करें ||
2 years ago
7:48
How to cleave surface and create vacuum slab ||Gaurav Jhaa
2 years ago
6:06
ELF (Electron localization function) Calculation and Analysis ||Gaurav Jhaa
2 years ago
3:28
X-ray diffraction pattern calculation in Materials Studio
2 years ago
12:59
New Concept of hybridization
2 years ago
8:55
Basis set superposition error || basis set part 5 || BSSE
2 years ago
7:35
Band Structure and Density of State (DOS) Analysis
2 years ago
4:32
How to choose a basis set in DFT calculations || part 4
2 years ago
7:49
How to choose a basis set in DFT calculations || part 3
2 years ago
4:15
How to choose a basis set in DFT calculations || part 2
2 years ago
5:54
How to choose a basis set in DFT calculations || part 1
2 years ago
13:16
A Guide to Adsorption, Binding Energy, AA.../AB... Stacking and Heterostructure Designing
2 years ago
15:04
Molecular Modeling Using Spartan
2 years ago
1:23
Mulliken Charge Calculation and Analysis Using Gaussian || Part 5
2 years ago
11:32
NBO Analysis and Hyperconjugation Effect in Gaussian
2 years ago
5:10
Transition State Calculation-TS Berny, QST2,QST3 in Gaussian
2 years ago
8:12
IRC Calculation in Gaussian
2 years ago
7:43
Gaussian Output file analysis #DFT
2 years ago
4:56
How to cleave the surface in Materials studio
2 years ago
2:21
Electrostatic Potential (ESP) Surface Calculations and Analysis Using Gaussian || Part 4
2 years ago
3:51
HOMO-LUMO Calculation and Analysis Using DFT method in Gaussian Software || Part 3
2 years ago
3:07
Frequency Calculation and Analysis Using DFT method in Gaussian Software || Part 2
2 years ago
5:03
Geometry Optimization Using DFT method in Gaussian Software || Part 1
2 years ago
3:59
Phonon Using CASTEP tool in Materials Studio
2 years ago