From 0970469c2cf2e8e9f4b252755562cc4089ccdfc6 Mon Sep 17 00:00:00 2001 From: Calysta Tesiman Date: Thu, 17 Aug 2023 17:42:26 +0100 Subject: [PATCH] update --- .DS_Store | Bin 10244 -> 10244 bytes macrodensity/density.py | 2 +- tests/__pycache__/unit_tests.cpython-311.pyc | Bin 26173 -> 26173 bytes 3 files changed, 1 insertion(+), 1 deletion(-) diff --git a/.DS_Store b/.DS_Store index 7ae7d697b3d2ea288d9be0d645962b1588472edf..5cd013bc99af0e229885e14e8763609d560c1261 100644 GIT binary patch delta 120 zcmZn(XbIS$DiCK-QOCf*z`~%%kj{|FP?DSP;*yk;p9B=+*!fs#wUhf%M^yO~yz&JZ jhQZ1CxdlKy41$guHa81svNIZNUMv2epV46QTJdlIk>DV* delta 120 zcmZn(XbIS$DiEjte-Q%%0}F#5LpnnyLrHGFi%U{YeiBfO np.ndarray: return a_grid #------------------------------------------------------------------------------ -def density_2_grid(Density: np.ndarray, nx: int, ny: int, nz: int, Charge: bool=False, Volume: float=1, Format: str = 'GULP') -> tuple: +def density_2_grid(Density: np.ndarray, nx: int, ny: int, nz: int, Charge: bool=False, Volume: float=1, Format: str = 'VASP') -> tuple: """ Convert density data to a 3D grid. diff --git a/tests/__pycache__/unit_tests.cpython-311.pyc b/tests/__pycache__/unit_tests.cpython-311.pyc index 870d868e5039a46f6281071d8dbc9c2a4b5f637e..4cddf11eb4bc8f5450b799411d198db8992c7e0b 100644 GIT binary patch delta 83 zcmdmchH>v1M&9MTyj%=G@YwfW%GQm%lYAK+Cok~bC?R)=LvBX#1!bR$9KKgLd@sPz bv1M&9MTyj%=G(BgS7W&K9pNxqD-lNb1I