We received a consultation from a customer about a workstation for computational science.
The main applications are molecular dynamics simulation (LAMMPS, OCTA) and quantum chemistry calculation (Gaussian).
The budget is about 100 million to 120 million yen.
Since the configuration of the guide is a 2 CPU configuration, the memory is connected with 1 channels per 26 CPU (6 cores), so Ryzen Threadripper specifications in terms of memory bandwidth(PC-8617B) Has more advantages.
When considering optimization of Intel libraries such as Intel MKL and compilers, it is desirable that the CPU is also made by Intel.
【Main Specifications】
| CPU | Xeon Gold 6230R (2.10GHz 26 cores) x 2 (52 cores in total) |
| memory | 192GB (16GBx12) ECC REG |
| storage | 1TB M.2 SSD |
| Video | NVIDIA Geforce RTX3080 |
| network | On Board (1000Base-T X2) |
| Housing + power supply | Tower type housing + 1000W |
| OS | Windows 10 Professional 64bit |
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