Drivers (qiskit_nature.second_q.drivers)#
Driver Base Class#
Base class for Qiskit Nature drivers. |
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Base class for Qiskit Nature's vibrational structure drivers. |
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Base class for Qiskit Nature's electronic structure drivers. |
Driver Common#
MethodType Enum |
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Initial Guess Enum |
Drivers#
The drivers in the chemistry module obtain their information from classical ab-initio programs or libraries. Several drivers, interfacing to common programs and libraries, are available. To use the driver its dependent program/library must be installed. See the relevant installation instructions below for your program/library that you intend to use.
Electronic Structure Drivers#
Qiskit Nature driver using the Gaussian™ 16 program. |
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Qiskit Nature driver using the Psi4 program. |
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A Second-Quantization driver for Qiskit Nature using the PySCF library. |
Vibrational Structure Drivers#
Gaussian™ 16 forces driver. |
General Driver#
The GaussianLogDriver allows an arbitrary Gaussian Job Control File to be run and
return a GaussianLogResult containing the log as well as ready access certain data
of interest that is parsed from the log.
Gaussian™ 16 log driver. |
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Result for Gaussian™ 16 log driver. |