http://rdf.ncbi.nlm.nih.gov/pubchem/patent/CN-109671471-A
Outgoing Links
Predicate | Object |
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assignee | http://rdf.ncbi.nlm.nih.gov/pubchem/patentassignee/MD5_edba331323cc8ac15a87318e17019827 |
classificationIPCInventive | http://rdf.ncbi.nlm.nih.gov/pubchem/patentipc/G16C20-40 |
filingDate | 2019-01-24-04:00^^<http://www.w3.org/2001/XMLSchema#date> |
inventor | http://rdf.ncbi.nlm.nih.gov/pubchem/patentinventor/MD5_450be36b4a057071b094653237b5c3f5 http://rdf.ncbi.nlm.nih.gov/pubchem/patentinventor/MD5_ccec68493379e891501fb8843c93b953 http://rdf.ncbi.nlm.nih.gov/pubchem/patentinventor/MD5_46665ec05ff835487cdbbbcdbb3a2350 http://rdf.ncbi.nlm.nih.gov/pubchem/patentinventor/MD5_e94d5d6824c22e1f4027a48601259e26 http://rdf.ncbi.nlm.nih.gov/pubchem/patentinventor/MD5_5c344ac0743b09258ec4c005d35a3d0b http://rdf.ncbi.nlm.nih.gov/pubchem/patentinventor/MD5_3e39af9c6fc5a6005c4943d0518f1853 http://rdf.ncbi.nlm.nih.gov/pubchem/patentinventor/MD5_d718746033eb9e801379f6398beb0a91 http://rdf.ncbi.nlm.nih.gov/pubchem/patentinventor/MD5_e51ef33834e31362f47d23d3e13aa1f0 |
publicationDate | 2019-04-23-04:00^^<http://www.w3.org/2001/XMLSchema#date> |
publicationNumber | CN-109671471-A |
titleOfInvention | A Method for Descriptor Electrocatalytic Performance of Metal-Organic Framework Materials |
abstract | The present invention provides a method for descriptors of electrocatalytic performance of metal-organic framework materials. The method obtains descriptors of electrocatalytic performance of metal-organic framework materials through high-throughput flow calculation, thereby realizing rapid screening of high-performance metal-organic framework electrocatalysis. materials, and at the same time selectively guide the synthesis of metal-organic framework materials according to the needs of different catalytic reactions. The invention adopts high-throughput concurrent computing, which effectively shortens the data acquisition time, avoids the waste of resources caused by the traditional experiment-intensive "trial and error" experiments, reduces the research and development cost, and shortens the research and development cycle. Moreover, the obtained descriptors can be used for rapid screening of catalytic materials, effectively reducing the amount of calculation when high-throughput computing guides material screening, and the interactive mode of real-time feedback of experimental data from a small number of samples to theoretical calculation enables The efficiency and accuracy of theoretical calculations can be continuously improved and optimized, which has good practical value. |
isCitedBy | http://rdf.ncbi.nlm.nih.gov/pubchem/patent/CN-115646548-A |
priorityDate | 2019-01-24-04:00^^<http://www.w3.org/2001/XMLSchema#date> |
type | http://data.epo.org/linked-data/def/patent/Publication |
Incoming Links
Total number of triples: 90.