Adsorption Energy Calculator

Calculate the total energy of adsorbates as they move around a metal organic framework

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Version 1.1 - published on 22 Nov 2019

doi:10.21981/KWND-0N31 cite this

Open source: license | download

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Usage

World usage

Location of all "Adsorption Energy Calculator" Users Since Its Posting

Cumulative Simulation Users

99

1 3 5 10 15 19 20 24 27 35 43 49 53 60 65 72 82 87 89 94 97 97 99

Users By Organization Type
Type Users
Unidentified 93 (93.94%)
Educational - University 5 (5.05%)
National Lab 1 (1.01%)
Users by Country of Residence
Country Users
th THAILAND 1 (20%)
bd BANGLADESH 1 (20%)
gr GREECE 1 (20%)
us UNITED STATES 1 (20%)
dz ALGERIA 1 (20%)

Simulation Runs

220

2 4 6 23 35 44 46 51 60 73 91 103 113 127 138 151 172 181 186 207 218 218 220
Overview
Average Total
Wall Clock Time 4.86 hours 30.36 days
CPU time 1.7 minutes 4.24 hours
Interaction Time 10.15 minutes 1.06 days