From 031ad07855444d1f55ae4a80d8849732d69ab936 Mon Sep 17 00:00:00 2001
From: VsevolodX <79542055+VsevolodX@users.noreply.github.com>
Date: Fri, 25 Oct 2024 18:46:05 -0700
Subject: [PATCH] update: add TiN

---
 materials/sources/manifest.yml  | 11 +++++++++++
 materials/sources/mp-492.poscar | 16 ++++++++++++++++
 2 files changed, 27 insertions(+)
 create mode 100644 materials/sources/mp-492.poscar

diff --git a/materials/sources/manifest.yml b/materials/sources/manifest.yml
index 0b83ad8..ca1f294 100644
--- a/materials/sources/manifest.yml
+++ b/materials/sources/manifest.yml
@@ -317,3 +317,14 @@ sources:
     source: Materials Project
     doi: 10.17188/1202679
     url: https://next-gen.materialsproject.org/materials/mp-2858
+
+  - filename: mp-492.poscar
+    common_name: Titanium Nitride
+    lattice_type: FCC
+    space_group: Fm-3m
+    dimensionality: 3D
+    form_factor: Bulk
+    source_id: mp-492
+    source: Materials Project
+    doi:
+    url: https://next-gen.materialsproject.org/materials/mp-492
diff --git a/materials/sources/mp-492.poscar b/materials/sources/mp-492.poscar
new file mode 100644
index 0000000..4a796bc
--- /dev/null
+++ b/materials/sources/mp-492.poscar
@@ -0,0 +1,16 @@
+Ti4 N4
+1.0
+   4.2412469017953978    0.0000000000000000    0.0000000000000003
+   0.0000000000000007    4.2412469017953978    0.0000000000000003
+   0.0000000000000000    0.0000000000000000    4.2412469017953978
+Ti N
+4 4
+direct
+   0.0000000000000000    0.0000000000000000    0.0000000000000000 Ti3+
+   0.0000000000000000    0.5000000000000000    0.5000000000000000 Ti3+
+   0.5000000000000000    0.0000000000000000    0.5000000000000000 Ti3+
+   0.5000000000000000    0.5000000000000000    0.0000000000000000 Ti3+
+   0.0000000000000000    0.5000000000000000    0.0000000000000000 N3-
+   0.0000000000000000    0.0000000000000000    0.5000000000000000 N3-
+   0.5000000000000000    0.5000000000000000    0.5000000000000000 N3-
+   0.5000000000000000    0.0000000000000000    0.0000000000000000 N3-