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A Computational Chemistry Alphabet for Curious Young Minds

21 Nov

How to Properly Cite VASP in Your Research Papers | A Guide with Examples and Formats

11 Dec

Exchange-Correlation Functionals [Explained for Beginners]

1 May

Why is chemical accuracy defined as 1 kcal/mol? [SOLVED]

29 Apr

C Program to find the sum of a Finite Series – Tutorial

C Programs Numerical Analysis Programming Series SumAug 22, 2017May 4, 2020 Manas Sharma

Finding the sum of a series(finite or infinite) is a crucial part of computational mathematics. Many mathematical functions can be simply expressed in…

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Alpha-Fe2O3 Nanoparticles Synthesis, Magnetic Properties and Applications

Nanoscience and NanotechnologyAug 21, 2017Oct 2, 2017 Manas Sharma

Hematite (α-Fe2O3) is one of the most important, stable, non-toxic, nature-friendly and corrosion-resistant metal oxides. Hematite crystallizes in the rhombohedral lattice system, and…

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Lissajous Figures – C Program

C Programs Plots and GraphsAug 19, 2017May 4, 2020 Manas Sharma

In this post I will show you how to calculate and plot the Lissajous Curves using C and Gnuplot. We will use the…

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Spherical Bessel Functions – C Program

C Programs Numerical Analysis Programming Plots and GraphsAug 19, 2017May 4, 2020 Manas Sharma

In this post I will show you how to calculate and plot the Spehrical Bessel Functions () of the first kind using C…

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Plotting exercises for C and GNUPlot

C Programs Plots and GraphsAug 19, 2017May 4, 2020 Manas Sharma

Gnuplot is a portable command-line driven graphing utility for Linux and other OS. C and Gnuplot can be used to plot complex functions.…

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Triangular Wave (Periodic Function) – C Program

C Programs Numerical Analysis Programming Plots and GraphsAug 18, 2017May 4, 2020 Manas Sharma

One might need to work with periodic functions in C for several reasons. Periodic functions are an important class of functions with numerous…

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FAQ : X-Ray Diffraction [VIVA QUESTIONS]

Lab Manual Nanoscience and NanotechnologyAug 18, 2017Oct 22, 2020 Manas Sharma

The following are some of the frequently asked questions regarding X-ray diffraction(XRD) technique. What is the principle behind X-ray crystallography? A. The main…

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C Program to print Harshad Numbers in a given range

C Programs MiscellaneousAug 18, 2017May 4, 2020 Manas Sharma

Harshad(or Niven) Numbers are those integers who are who are divisible by the sum of their digits. The following program prints the Harshad…

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programming coding blue hands digital keyboard fingers

C Program to find the roots of a Quadratic Equation

C Programs MiscellaneousAug 18, 2017May 4, 2020 Manas Sharma

In this post I show you how to write a C program that finds the roots(both real and complex) of a quadratic equation.…

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C Program to find the Factorial of a number

C Programs MiscellaneousAug 18, 2017May 4, 2020 Manas Sharma

Factorial is defined for a positive integer, n, as the product of all the integers from 1 to n. Factorial of n is…

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programming coding blue hands digital keyboard fingers

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Latest Articles

  • A Computational Chemistry Alphabet for Curious Young Minds
    Nov 21, 2025
  • How to Properly Cite VASP in Your Research Papers | A Guide with Examples and Formats
    Dec 11, 2024
  • Exchange-Correlation Functionals [Explained for Beginners]
    May 1, 2024
  • Why is chemical accuracy defined as 1 kcal/mol? [SOLVED]
    Apr 29, 2024
  • What is Electron Correlation? [EXPLAINED]
    Dec 4, 2023
  • Automate Bulk Downloading of Molecular Properties and 3D Structures from ChemSpider with Python and Chemspipy
    Nov 16, 2023

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