inter_stress.zip
Experimental_data
Cu111.txt
78.3 kB
Readme.docx
33.7 kB
W110.txt
78.3 kB
Simulation_data
Generic
bulk_cu
bulk_cu
139.9 kB
dump.-0.005
107.8 kB
dump.-0.0075
107.5 kB
dump.0.0025
108.2 kB
dump.0.005
107.8 kB
dump.0.0075
107.6 kB
dump.0.01
107.0 kB
dump.relax
138.4 kB
dump.strain-0.01
107.9 kB
elastic_constants.dat
660 Bytes
in.relax
625 Bytes
in.strain
1.6 kB
log.lammps
49 Bytes
log.relax
56.3 kB
log.strain2
323.1 kB
restart_cu
297.6 kB
run.sh
286 Bytes
bulk_w
bulk_w
95.0 kB
dump.-0.0025
82.4 kB
dump.-0.005
81.7 kB
dump.-0.0075
81.0 kB
dump.0.0025
82.8 kB
dump.0.005
81.8 kB
dump.0.0075
81.6 kB
dump.0.01
82.3 kB
dump.relax
105.6 kB
dump.strain-0.01
81.6 kB
elastic_constants.dat
1.0 kB
in.relax
618 Bytes
in.strain
1.6 kB
log.lammps
49 Bytes
log.relax
56.4 kB
log.strain2
499.3 kB
restart_w
228.6 kB
run.sh
286 Bytes
dump.-0.0025
180.0 kB
dump.-0.005
180.2 kB
dump.-0.0075
180.1 kB
dump.-0.01
180.0 kB
dump.0.0025
180.2 kB
dump.0.005
180.3 kB
dump.0.0075
180.3 kB
dump.0.01
180.2 kB
dump.relax
232.6 kB
dump1.relax
233.6 kB
in.relax
480 Bytes
in.relax1
489 Bytes
in.strain
1.6 kB
potential.mod
556 Bytes
restart.relax
520.4 kB
restart1.relax
520.4 kB
KS
KS.dat
1.9 MB
bulk_cu
KS_cu
300.8 kB
dump.relax
291.8 kB
dump.strain-0.00249999999999995
290.1 kB
dump.strain-0.005
291.0 kB
dump.strain-0.00749999999999995
291.1 kB
dump.strain-0.01
290.0 kB
dump.strain0.00249999999999995
292.6 kB
dump.strain0.00499999999999989
290.3 kB
dump.strain0.00750000000000006
291.7 kB
dump1.relax
291.2 kB
elastic_constants.dat
776 Bytes
in.relax
1.1 kB
in.strain
1.6 kB
log.lammps
36 Bytes
log.relax
55.1 kB
log.strain2
252.8 kB
output
54.2 kB
restart.relax
829.8 kB
restart1.relax
829.8 kB
run.sh
286 Bytes
bulk_w
KS_w
236.3 kB
dump.relax
229.7 kB
dump.strain-0.005
229.3 kB
dump.strain-0.00749999999999995
229.0 kB
dump.strain-0.01
228.2 kB
dump.strain0.00499999999999989
229.8 kB
dump.strain0.00750000000000006
230.0 kB
dump.strain0.01
229.5 kB
dump1.relax
296.8 kB
elastic_constants.dat
754 Bytes
in.relax
1.1 kB
in.strain
1.6 kB
log.lammps
36 Bytes
log.relax
56.6 kB
log.strain2
215.5 kB
output
55.7 kB
restart1.relax
660.8 kB
run.sh
286 Bytes
dump.strain-0.00249999999999995
524.9 kB
dump.strain-0.00749999999999995
524.8 kB
dump.strain-0.01
524.2 kB
dump.strain0.00249999999999995
521.0 kB
dump.strain0.00499999999999989
525.5 kB
dump.strain0.00750000000000006
525.8 kB
dump.strain0.01
525.7 kB
dump1.relax
524.8 kB
elastic_constants.dat
659 Bytes
in.relax
1.0 kB
in.strain
1.6 kB
log.lammps
49 Bytes
log.strain2
216.3 kB
potential.mod
556 Bytes
restart1.relax
1.5 MB
run.sh
286 Bytes
NW
NW.dat
192.6 kB
bulk_cu
NW_cu
59.3 kB
dump.relax
74.5 kB
dump.strain-0.00249999999999995
57.7 kB
dump.strain-0.005
57.4 kB
dump.strain-0.00749999999999995
57.5 kB
dump.strain-0.01
57.8 kB
dump.strain0.00249999999999995
57.5 kB
dump.strain0.00499999999999989
57.6 kB
dump.strain0.00750000000000006
57.8 kB
dump.strain0.01
57.6 kB
dump1.relax
74.4 kB
elastic_constants.dat
1.0 kB
in.relax
1.1 kB
in.strain
1.6 kB
log.lammps
36 Bytes
log.relax
42.2 kB
log.strain2
489.8 kB
output
41.3 kB
restart.relax
167.3 kB
restart1.relax
167.3 kB
restart2.relax
167.3 kB
run.sh
286 Bytes
bulk_w
NW_w
48.1 kB
dump.relax
58.3 kB
dump.strain-0.00249999999999995
46.6 kB
dump.strain-0.005
45.4 kB
dump.strain-0.00749999999999995
46.5 kB
dump.strain-0.01
46.3 kB
dump.strain0.00249999999999995
46.4 kB
dump.strain0.00499999999999989
46.5 kB
dump.strain0.00750000000000006
46.2 kB
dump.strain0.01
46.8 kB
elastic_constants.dat
1.0 kB
in.relax
1.1 kB
in.strain2
1.6 kB
log.lammps
36 Bytes
log.relax
50.3 kB
log.strain2
499.7 kB
output
49.3 kB
restart.relax
137.0 kB
run.sh
286 Bytes
dump.relax
135.4 kB
dump.strain-0.00249999999999995
105.6 kB
dump.strain-0.005
105.9 kB
dump.strain-0.00749999999999995
105.6 kB
dump.strain-0.01
105.6 kB
dump.strain0.00249999999999995
105.6 kB
dump.strain0.00499999999999989
105.8 kB
dump.strain0.00750000000000006
106.0 kB
dump.strain0.01
105.8 kB
dump1.relax
135.4 kB
elastic_constants.dat
785 Bytes
in.relax
996 Bytes
in.strain
1.6 kB
log.lammps
49 Bytes
log.relax
56.6 kB
log.strain2
315.3 kB
potential.mod
556 Bytes
restart.relax
306.0 kB
restart1.relax
306.0 kB
run.sh
286 Bytes
ReadMe.docx
34.2 kB
bcc-bcc_Cu
dump.relax
242.6 kB
dump.strain-0.00249999999999995
187.8 kB
dump.strain-0.005
187.2 kB
dump.strain-0.00749999999999995
187.4 kB
dump.strain-0.01
186.8 kB
dump.strain0.00249999999999995
187.7 kB
dump.strain0.00499999999999989
187.6 kB
dump.strain0.00750000000000006
188.1 kB
dump.strain0.01
187.7 kB
elastic_constants.dat
1.0 kB
in.relax
684 Bytes
in.strain
1.6 kB
log.lammps
49 Bytes
log.relax
56.6 kB
log.strain2
272.6 kB
restart.relax
541.1 kB
restart1.relax
541.1 kB
run.sh
286 Bytes
bcc-bcc_CuW
dump.relax
241.8 kB
dump.strain-0.00249999999999995
187.3 kB
dump.strain-0.005
187.5 kB
dump.strain-0.00749999999999995
187.3 kB
dump.strain-0.01
187.2 kB
dump.strain0.00249999999999995
187.4 kB
dump.strain0.00499999999999989
187.3 kB
dump.strain0.00750000000000006
187.3 kB
dump.strain0.01
187.3 kB
dump.strain1_-0.01
240.2 kB
dump.strain1_0.01
241.9 kB
elastic_constants.dat
1.0 kB
in.relax
736 Bytes
in.strain
1.6 kB
log.lammps
49 Bytes
log.relax
56.7 kB
log.strain2
272.7 kB
restart.relax
541.1 kB
restart1.relax
541.1 kB
run.sh
286 Bytes
bcc-fcc_CuW
dump.relax
243.1 kB
dump.strain-0.00249999999999995
188.4 kB
dump.strain-0.005
188.1 kB
dump.strain-0.00749999999999995
188.0 kB
dump.strain-0.01
188.2 kB
dump.strain0.00249999999999995
188.3 kB
dump.strain0.00499999999999989
188.3 kB
dump.strain0.00750000000000006
188.5 kB
dump.strain0.01
188.3 kB
dump.strain1_-0.01
241.5 kB
dump.strain1_0.01
242.9 kB
elastic_constants.dat
1.0 kB
in.relax
796 Bytes
in.strain
1.6 kB
log.lammps
49 Bytes
log.relax
56.9 kB
log.strain2
273.2 kB
restart.relax
542.6 kB
restart1.relax
543.6 kB
run.sh
286 Bytes
inter_stress.xlsx
21.0 kB