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MPQC

Massively Parallel Quantum Chemistry program

As of 2013-08-16, this project may now be found at https://github.com/ValeevGroup/mpqc.

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Description

The Massively Parallel Quantum Chemistry program, MPQC, computes properties of atoms and molecules from first principles using the time independent Schrödinger equation.

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Additional Project Details

Intended Audience

Developers, Education, End Users/Desktop, Science/Research

User Interface

Command-line

Programming Language

C++

Registered

2000-06-05

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