ReaxFF

By Michael Russo, Adri van Duin1

1. Penn State University

ReaxFF code for simulating atomic systems

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Version 1.9b - published on 06 Aug 2014

doi:10.4231/D3WH2DF8S cite this

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Usage

World usage

Location of all "ReaxFF" Users Since Its Posting

Simulation Users

236

9 13 23 25 28 28 29 30 33 34 34 34 34 34 34 34 34 36 36 44 44 47 49 49 49 52 52 53 53 56 58 68 68 71 72 73 73 74 76 78 79 84 88 93 96 97 100 100 100 103 106 108 110 115 124 143 146 150 151 152 154 160 160 160 162 167 172 175 177 181 182 183 185 191 200 206 207 210 219 228 230 234 236

Users By Organization Type
Type Users
Unidentified 150 (63.29%)
Educational - University 82 (34.6%)
Industry 3 (1.27%)
Government Agency 1 (0.42%)
National Lab 1 (0.42%)
Users by Country of Residence
Country Users
us UNITED STATES 57 (76%)
dz ALGERIA 3 (4%)
br BRAZIL 3 (4%)
cn CHINA 3 (4%)
in INDIA 2 (2.67%)
se SWEDEN 2 (2.67%)
de GERMANY 2 (2.67%)
cl CHILE 1 (1.33%)
ro ROMANIA 1 (1.33%)
co COLOMBIA 1 (1.33%)

Simulation Runs

3,753

70 114 521 699 712 713 733 735 749 753 753 753 753 753 753 753 753 771 771 972 976 1025 1067 1107 984 997 1039 1040 1040 1067 1089 1390 1390 1398 1402 1407 1409 1411 1419 1425 1431 1451 1467 1574 1583 1588 1598 1602 1602 1632 1638 1648 1653 1680 1696 2537 2616 2626 2627 2633 2701 2855 2923 2975 3040 3088 3215 3693 3711 3745 3749 3750 3754 3775 3839 3858 3859 3872 3893 4246 3729 3742 3753
Overview
Average Total
Wall Clock Time 1.41 hours 145.83 days
CPU time 20.65 seconds 14.23 hours
Interaction Time 27.85 minutes 48.01 days