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nomad-lab
analytics-toolkit-tutorials
Commits
7f12fa07
Commit
7f12fa07
authored
7 years ago
by
Mohamed, Fawzi Roberto (fawzi)
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relaxing clusterX-x1.demoinfo.yaml from json to yaml
parent
95f3df20
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cluster-x/clusterX-x1.demoinfo.yaml
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7f12fa07
{
"
id"
:
"
59fb07f59784de0031020891"
,
"
type"
:
"
demos"
,
"
attributes"
:
{
"
title"
:
"
Predicting
ground-states
of
binary
alloys
through
cluster
expansion:
Example
of
a
AlNa
binary
surface
alloy"
,
"
logicalPath"
:
"
/data/shared/rsant/clusterX-x1.bkr"
,
"
authors"
:
[
"
Santiago
Rigamonti"
,
"
Maria
Troppenz"
,
"
Claudia
Draxl"
],
"
editLink"
:
"
/notebook-edit/data/shared/rsant/clusterX-x1.bkr"
,
"
isPublic"
:
true
,
"
username"
:
"
rsant"
,
"
description"
:
"
A
tool
for
predicting
ground
state
configurations
of
binary
alloys.
In
this
tutorial,
the
ground
state
configurations
of
a
AlNa
surface
alloy
are
found.
Starting
from
a
set
of
ab
initio
data
for
random
configurations
of
the
alloy,
a
cluster
expansion
is
performed
and
the
ground
states
are
found
through
a
configurational
sampling."
,
"
created_at"
:
"
2017-10-06T16:00:10.746Z"
,
"
updated_at"
:
"
2017-10-06T16:00:10.746Z"
,
"
labels"
:
{
"
category"
:
[
"
Demo"
],
"
platform"
:
[
"
beaker"
],
"
language"
:
[
"
python"
],
"
data_analytics_method"
:
[
"
Cluster
expansion"
],
"
application_section"
:
[
"
Predicting
ground-states
of
alloys
(convex
hull
construction)"
],
"
application_keywords"
:
[
"
Binary
alloys"
,
"
Surface"
,
"
AlNa"
]
}
}
}
title
:
"
Predicting
ground-states
of
binary
alloys
through
cluster
expansion:
Example
of
a
AlNa
binary
surface
alloy"
logicalPath
:
"
/data/shared/rsant/clusterX-x1.bkr"
authors
:
[
"
Santiago
Rigamonti"
,
"
Maria
Troppenz"
,
"
Claudia
Draxl"
]
editLink
:
"
/notebook-edit/data/shared/rsant/clusterX-x1.bkr"
isPublic
:
true
username
:
"
rsant"
description
:
"
A
tool
for
predicting
ground
state
configurations
of
binary
alloys.
In
this
tutorial,
the
ground
state
configurations
of
a
AlNa
surface
alloy
are
found.
Starting
from
a
set
of
ab
initio
data
for
random
configurations
of
the
alloy,
a
cluster
expansion
is
performed
and
the
ground
states
are
found
through
a
configurational
sampling."
created_at
:
"
2017-10-06T16:00:10.746Z"
updated_at
:
"
2017-10-06T16:00:10.746Z"
labels
:
category
:
[
"
Demo"
]
platform
:
[
"
beaker"
]
language
:
[
"
python"
]
data_analytics_method
:
[
"
Cluster
expansion"
]
application_section
:
[
"
Predicting
ground-states
of
alloys
(convex
hull
construction)"
]
application_keywords
:
[
"
Binary
alloys"
,
"
Surface"
,
"
AlNa"
]
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