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Tag: programming

How to parse (read) .XYZ atomic coordinates file using Python? [TUTORIAL]

Quantum ChemistryJul 4, 2023 Manas Sharma

In this post, I am going to show you guys how to read the atomic coordinates in the .XYZ file format using Python…

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Random Walk (1d) – C PROGRAM

C Programs Numerical Analysis Programming Random NumbersFeb 28, 2018Jun 6, 2018 Manas Sharma

In the last post I wrote about how to simulate a coin toss/flip using random numbers generated within the range: . We can…

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Coin Toss – C PROGRAM

C Programs Numerical Analysis Programming Random NumbersFeb 24, 2018Jun 6, 2018 Manas Sharma

In the last few posts I have been talking a lot about generating random numbers using C programming. We performed some basic checks…

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Random Number b/w 0 and 1 – C PROGRAM

C Programs Numerical Analysis Programming Random NumbersFeb 24, 2018Jun 6, 2018 Manas Sharma

In the last few posts I have been talking about random number generation using simple algorithms, and then testing if the numbers are…

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programming coding blue hands digital keyboard fingers

Post-processing and Statistical Checks for Random Numbers – C PROGRAM

C Programs Numerical Analysis Programming Random NumbersFeb 24, 2018Jun 6, 2018 Manas Sharma

In the last post I wrote about random numbers and how to generate them. Now even though, the random number sequence generated from…

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Random Number Generator – C PROGRAM

C Programs Numerical Analysis Programming Random NumbersFeb 24, 2018Jun 6, 2018 Manas Sharma

Wikipedia defines random numbers as a sequence of numbers or symbols that cannot be reasonably predicted better than by a random chance In…

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Cubic Spline (Piecewise Interpolation) – C PROGRAM

C Programs Numerical Analysis ProgrammingFeb 18, 2018Feb 28, 2018 Manas Sharma

Lagrange or Newton polynomial interpolations are useful interpolation techniques to have in your sleeves, but they don’t always give the best or desired…

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Linear Spline – Piecewise Interpolation [C PROGRAM]

C Programs Numerical Analysis ProgrammingFeb 9, 2018Feb 28, 2018 Manas Sharma

Lagrange or Newton polynomial interpolations are useful interpolation techniques to have in your sleeves, but they don’t always give the best or desired…

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Gauss Elimination – EXERCISES [C Programming]

C Programs Matrix Operations Numerical Analysis ProgrammingFeb 5, 2018Feb 28, 2018 Manas Sharma

In this post we will be doing a few problems on Gauss-Elimination. These problems/exercises were given in my Numerical Analysis class. These will…

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Modifying Gauss-Elimination for Tridiagonal Systems – C PROGRAM

C Programs Matrix Operations Numerical Analysis ProgrammingFeb 5, 2018Feb 28, 2018 Manas Sharma

There are many situations in numerical analysis where we deal with tridiagonal systems instead of a complete set of equations. Therefore, using the…

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