Comments (1)
I am not interested in this any more.
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Related Issues (20)
- ensemble npt and F_e HOT 4
- nep executable error - "no kernel image is available for execution on the device" HOT 10
- units of input stress in trian.xyz/test.xyz HOT 2
- cudaErrorIllegalAddress: an illegal memory access was encountered HOT 8
- add force due to external electric field HOT 1
- Generate seperate frames by dump_exyz HOT 1
- trajectory file "dump.xyz" fails to include initial model.xyz as a start. HOT 1
- The keyword "velocity" in "run.in" to initialize the velocities of the system atoms might be given a reference value by default. HOT 1
- Possible BUG of enhance sampling perfomed by gpumd+plumed HOT 4
- Questions about NEP descriptors,Why is there an extra factor(2) in the derivation? HOT 5
- Add output for stopping_power_loss in electron_stop HOT 1
- A BUG of compute_rdf HOT 1
- it would be better if GPUMD could consider constant potential. HOT 1
- the eigenvector. out output from the phono function module is a binary file. HOT 1
- How to output unwrap coordinates? HOT 1
- correct linear and angular momenta at regular intervals
- CUDA Error:700 Error text: an illegal memory access was encountered HOT 4
- Custom loss function
- Separate deform Functionality for Mechanical Calculations HOT 1
- Adding reminder to check the input xyz file. HOT 1
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