Quantum chemistry code for modern hardware with punch. The GPUnCH development is supported by the Swedish e-Science Research Centre. XCint integrates the exchange-correlation (XC) energy, the XC potential matrix elements, and their derivatives in a Gaussian-type basis set. Web fonts from Google.
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GPUnCH | gpunch.org Reviews
https://gpunch.org
Quantum chemistry code for modern hardware with punch. The GPUnCH development is supported by the Swedish e-Science Research Centre. XCint integrates the exchange-correlation (XC) energy, the XC potential matrix elements, and their derivatives in a Gaussian-type basis set. Web fonts from Google.
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GPUnCH
Quantum chemistry code for modern hardware with punch. The GPUnCH development is supported by the Swedish e-Science Research Centre. XCint integrates the exchange-correlation (XC) energy, the XC potential matrix elements, and their derivatives in a Gaussian-type basis set. Web fonts from Google.
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