yuanpeng / G2full_ARMmac.sh

Last active 4 months ago

0 0 1

1	WORKSPACE=/tmp
2	condaHome=/tmp/conda311
3
4	gitInstallRepo=[email protected]:AdvancedPhotonSource/GSAS-II-buildtools.git
5	gitCodeRepo=https://github.com/AdvancedPhotonSource/GSAS-II.git
6
7	pyver=3.11
8	numpyver=1.26
9
10	packages="python=$pyver wxpython numpy=$numpyver scipy matplotlib pyopengl conda anaconda-client git gitpython requests pillow h5py imageio scons cython seekpath"

yuanpeng / ADDIE Nginx Configuration

Last active 4 months ago

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1	user www-data;
2	worker_processes auto;
3	pid /run/nginx.pid;
4	include /etc/nginx/modules-enabled/*.conf;
5	error_log /var/log/nginx/error.log;
6
7	include /usr/share/nginx/modules/*.conf;
8
9	events {
10	worker_connections 1024;

yuanpeng / res_filter_template.json

Last active 4 months ago

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1	{
2	"Facility": "SNS",
3	"Instrument": "NOM",
4	"Title": "ceriaDP375_PAC06_at_300K_IDL_Calib_rf_on",
5	"Sample": {
6	"Runs": "143157",
7	"Background": {
8	"Runs": "143230",
9	"Background": {
10	"Runs": "143074"

yuanpeng / si_mts.json

Last active 4 months ago

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1	{
2	"Facility": "SNS",
3	"Instrument": "NOM",
4	"Title": "NOM_Si_640d_sgb_12_by_12",
5	"Sample": {
6	"Runs": "197077",
7	"Background": {
8	"Runs": "197075",
9	"Background": {
10	"Runs": "197073"

yuanpeng / submit.slurm

Last active 4 months ago

0 0 2

Run Jobs on NERSC

1. First, download the RMCProfile package on Linux platform here and untar it somewhere in our home directory. Once logged onto NERSC from terminal, we can do this,

   cd SOMEWHERE
   wget https://yr.iris-home.net/rmclinux -O RMCProfile_V6.7.9_Linux_64.tgz
   tar xzvf RMCProfile_V6.7.9_Linux_64.tgz
   

yuanpeng / rebin_example.py

Last active 4 months ago

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1	from mantid.simpleapi import *
2	import matplotlib.pyplot as plt
3	import numpy as np
4
5
6	def rebin_data(datax, datay, xmin, xmax, xbin):
7	"""Rebin input data with specified binning params
8
9	Parameters:
10	datax (numpy.ndarray): Input data X array

yuanpeng / snippet.py

Last active 4 months ago

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1	if "-" in str(energy_theory[0]):
2	energy_theory = energy_theory[1:]
3	Percentage_theory = Percentage_theory[1:]

yuanpeng / slurm_example.sh

Last active 4 months ago

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1	#!/bin/bash
2	#
3	#SBATCH --job-name=MY_JOB_NAME
4	#SBATCH --output=MY_OUTPUT_NAME.out
5	#
6	#SBATCH --ntasks=1
7	#SBATCH --cpus-per-task=4
8	#SBATCH --time=1000000:00
9	#SBATCH --mem-per-cpu=256

yuanpeng / rmc2cif

Last active 4 months ago

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1	data2config -noannotate -order "[Ga P O]" -supercell "[1 1 1]" -cif gapo4_xray.rmc6f

yuanpeng / rmc2cif_win_linux

Last active 4 months ago

0 0 1

1	data2config -noannotate -order [Ga P O] -supercell [1 1 1] -cif gapo4_xray.rmc6f