ContainersNVIDIADeepSeek-R1NVIDIALlama-3.1-Nemotron-70B-InstructNVIDIAPyTorch
CollectionsNVIDIAOmniverse Kit (FB)NVIDIADeepStream SDKNVIDIAOmniverse Kit App Streaming
ModelsNVIDIAStyleGAN3 pretrained modelsNVIDIAPeopleNetNVIDIATrafficCamNet
ResourcesNVIDIARiva Skills Quick Start
Helm ChartsNVIDIAGPU OperatorNVIDIANVIDIA NIM Operator
SISSA
Quantum ESPRESSO
Container
SISSA
Quantum ESPRESSO

Quantum ESPRESSO is an integrated suite of Open-Source computer codes for electronic-structure calculations and materials modeling at the nanoscale based on density-functional theory, plane waves, and pseudopotentials.

LayerLabelCreated
6caf8cef2c74427338a750aac3936fc510c7c1223f3342e4aedbf31bd0ce3ee5RUN
/bin/sh
10/22/2024 12:51 PM UTC
1a51ce37425f74be9af32a283131e58ef12ebb7fd464d114732adcb041329633RUN
mkdir -p /opt/q-e/bin/ &&
  ln -sf /usr/local/qe/bin/pw.x /opt/q-e/bin/pw.x
10/22/2024 12:51 PM UTC
be69933d88280ddf5f3e3fbba211f774ad2813a7f1604c05f433c1253d78ae10ENV
PATH=/usr/local/qe/bin:/usr/local/openmpi/bin:/usr/local/ucx/bin:/usr/local/nvidia/bin:/usr/local/cuda/bin:/usr/local/sbin:/usr/local/bin:/usr/sbin:/usr/bin:/sbin:/bin
10/22/2024 12:51 PM UTC
a69089f09b7859bfec01679499d82e9c23e6b052f91937f27853cb04b3672712RUN
apt-get update -y &&
  DEBIAN_FRONTEND=noninteractive apt-get install -y --no-install-recommends libgfortran5 libgomp1 &&
  rm -rf /var/lib/apt/lists/*
10/22/2024 12:51 PM UTC
25b6a0c1517ca27293bd939c589dd5e8149c7b38d3e05955ea358ccf76a60311ENTRYPOINT
["/usr/bin/nventry" "-try_lazy_loading"]
10/22/2024 12:50 PM UTC
400bb8baa05dcdbf3414b7e813ea16bf797596aa89ce0522588fb45a2e03613cCOPY
file:228bcd2fab359acddc8f16d0370da826d9c9400a0a6b45267b8e8f75c8af2ae8 in /usr/bin/nventry
10/22/2024 12:50 PM UTC
19256928cb9b780a7eeffcc08e6c6d2fbda842a8f838c8d0a765414a342db542RUN
ldconfig
10/22/2024 12:50 PM UTC
e1965f58004eb085079eb1691b36ec979688d94071ce1f0fadd3a53b7c03381dRUN
mkdir /host_pwd
10/22/2024 12:50 PM UTC
6f8efb43f7a494a93b3438d5d288f6226740375a6a92278a68b4c7f929b0ec6aCOPY
multi:1940b186d791d12697fd5cf0d670c37db97ffa489cd4bd08b683d56f27a27f03 in /usr/src/
10/22/2024 12:50 PM UTC
90e58f751e9ee5b9ade07f077572abc96d4837e1c301cad372f5812720af465eENV
UCX_MEMTYPE_CACHE=n
10/22/2024 12:50 PM UTC