dockerfile.run

iotk

Electronic-Structure and Ab-Initio Molecular Dynamics Suite

Debian

RUN apt-get update && \
    apt-get install -y quantum-espresso

Ubuntu

RUN apt-get update && \
    apt-get install -y quantum-espresso

Kali Linux

RUN apt-get update && \
    apt-get install -y quantum-espresso

Fedora

RUN dnf install -y quantum-espresso

Raspbian

RUN apt-get update && \
    apt-get install -y quantum-espresso

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