gpaw-python
DFT and beyond within the projector-augmented wave method
RUN apt-get update && \
apt-get install -y gpaw
RUN apt-get update && \
apt-get install -y gpaw
RUN apt-get update && \
apt-get install -y gpaw
RUN dnf install -y gpaw
RUN apt-get update && \
apt-get install -y gpaw