diff --git a/Quickstart.ipynb b/InteractiveMode_Colab.ipynb similarity index 99% rename from Quickstart.ipynb rename to InteractiveMode_Colab.ipynb index dd0e5f3..15f9362 100644 --- a/Quickstart.ipynb +++ b/InteractiveMode_Colab.ipynb @@ -16,7 +16,7 @@ "id": "4_8SNZuAcJWY" }, "source": [ - "# DebyeCalculator - QuickStart (Interactive)\n", + "# DebyeCalculator - Interactive Mode\n", "\n", "**Authors:** Johansen & Anker et. al.\n", "\n", @@ -37,7 +37,7 @@ "id": "yHOtCs0rrS2S" }, "source": [ - "# Install and import DebyeCalculator" + "### Install and import DebyeCalculator" ] }, { @@ -61,7 +61,7 @@ "id": "x39dIoiJrTQj" }, "source": [ - "# Run DebyeCalculator" + "### Run DebyeCalculator" ] }, { diff --git a/quickstart/QuickStart.ipynb b/QuickStart.ipynb similarity index 100% rename from quickstart/QuickStart.ipynb rename to QuickStart.ipynb diff --git a/quickstart/tutorial_output/timings_cpu.csv b/quickstart/tutorial_output/timings_cpu.csv deleted file mode 100644 index 8b16c73..0000000 --- a/quickstart/tutorial_output/timings_cpu.csv +++ /dev/null @@ -1,9 +0,0 @@ -# diameter, n_atoms, mu, sigma -4.213586,5.000000,0.000898,0.000513 -8.068403,23.000000,0.001071,0.000089 -10.603959,47.000000,0.001423,0.000221 -12.640759,77.000000,0.002722,0.000204 -15.952379,161.000000,0.010521,0.000906 -17.373060,185.000000,0.014373,0.001254 -18.686039,287.000000,0.029338,0.001293 -21.067930,383.000000,0.055020,0.004593 diff --git a/quickstart/tutorial_output/timings_cuda_NVIDIA RTX A3000 Laptop GPU.csv b/quickstart/tutorial_output/timings_cuda_NVIDIA RTX A3000 Laptop GPU.csv deleted file mode 100644 index e8c96d6..0000000 --- a/quickstart/tutorial_output/timings_cuda_NVIDIA RTX A3000 Laptop GPU.csv +++ /dev/null @@ -1,9 +0,0 @@ -# diameter, n_atoms, mu, sigma -4.213586,5.000000,0.052513,0.154365 -8.068403,23.000000,0.001234,0.000205 -10.603959,47.000000,0.001219,0.000204 -12.640759,77.000000,0.001342,0.000105 -15.952379,161.000000,0.003204,0.000041 -17.373060,185.000000,0.003914,0.000149 -18.686039,287.000000,0.008507,0.000574 -21.067930,383.000000,0.013687,0.000430 diff --git a/quickstart/tutorial_output/timings_diffpy.csv b/quickstart/tutorial_output/timings_diffpy.csv deleted file mode 100644 index f951122..0000000 --- a/quickstart/tutorial_output/timings_diffpy.csv +++ /dev/null @@ -1,11 +0,0 @@ -# diameter, n_atoms, mu, sigma -31.811878,1367.000000,2.307051,0.000000 -29.495102,1079.000000,1.525399,0.000000 -27.843697,845.000000,0.969698,0.000000 -25.164200,701.000000,0.681239,0.000000 -22.163090,473.000000,0.309264,0.000000 -21.067930,383.000000,0.210706,0.000000 -18.686039,287.000000,0.117608,0.000000 -17.373060,185.000000,0.046238,0.000000 -15.952379,161.000000,0.036190,0.000000 -12.640759,77.000000,0.009377,0.000000