DFT Material Properties Simulator

By Gustavo Javier1; Usama Kamran2; David M Guzman3; Alejandro Strachan3; Peilin Liao3; Robert Joseph Appleton4

1. University of California, Los Angeles 2. School of Electrical and Computer Engineering, Purdue University 3. School of Materials Engineering, Purdue University 4. Purdue University

Compute electronic and mechanical properties of materials from DFT calculations with 1-Click

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Version 2.0.4 - published on 28 Feb 2023

doi:10.21981/CX4M-3H68 cite this

This tool is closed source.

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Usage

World usage

Location of all "DFT Material Properties Simulator" Users Since Its Posting

Cumulative Simulation Users

3,508

28 68 81 92 103 109 132 168 192 205 214 230 243 275 297 315 329 346 350 372 397 416 444 451 463 480 574 606 630 650 676 708 730 749 762 897 918 946 1,147 1,245 1,277 1,303 1,317 1,340 1,357 1,375 1,392 1,422 1,433 1,457 1,498 1,553 1,563 1,635 1,661 1,691 1,722 1,751 1,783 1,796 1,812 1,837 1,851 1,871 1,887 1,903 1,946 2,000 2,015 2,032 2,051 2,168 2,183 2,213 2,223 2,242 2,257 2,283 2,322 2,334 2,359 2,417 2,499 2,517 2,535 2,566 2,590 2,632 2,666 2,685 2,728 2,778 2,799 2,889 2,909 2,930 2,951 2,971 3,133 3,260 3,277 3,329 3,392 3,481 3,508

Simulation Runs

59,285

155 297 557 590 627 656 751 907 1269 1415 1525 1609 1647 2879 3744 3921 4026 4067 4129 4426 4685 5086 5992 6147 6275 6455 7584 8616 9303 9450 9715 10168 10548 10951 11181 12526 12694 12985 14608 16097 17065 18792 19935 20413 20472 20555 20602 20695 20719 20877 21074 21512 22057 22655 23630 24238 24785 24917 24995 25026 25170 25651 25812 26071 26171 26580 26911 28416 28517 28711 28772 29641 29707 30049 30078 30826 31051 31130 32442 33097 33254 33698 34151 34239 34282 34515 34831 35057 35410 35609 36506 39996 44299 45535 45663 45844 46119 48036 52219 53113 53206 53494 54248 57647 59285
Overview
Average Total
Wall Clock Time 3.66 hours 6621.2 days
CPU time 8.25 minutes 248.94 days
Interaction Time 23.9 minutes 721.01 days