Please use this identifier to cite or link to this item: http://hdl.handle.net/20.500.12188/21651
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dc.contributor.authorKoteska, Bojanaen_US
dc.contributor.authorPejov, LJupchoen_US
dc.contributor.authorMishev, Anastasen_US
dc.date.accessioned2022-07-28T08:54:42Z-
dc.date.available2022-07-28T08:54:42Z-
dc.date.issued2021-
dc.identifier.citationBojana Koteska, Ljupco Pejov, and Anastas Mishev. “Schr ̈odinger API - web service for solving multidimensional time-independent Schr ̈odinger equation using Hermite DVR approach”. In: Proceedings of the 18th Conference for Informatics and Information Technol- ogy. Online Conference, North Macedonia: Faculty of Computer Science and Engineering, Skopje, Macedonia, 2021, pp. 100–105. ISBN: 978-608-4699-11-8en_US
dc.identifier.isbn978-608-4699-11-8-
dc.identifier.urihttp://hdl.handle.net/20.500.12188/21651-
dc.description.abstractNumerous phenomena taking place in the nano-world are inherently quantum in nature. Their description and, more important, quantitative treatment, therefore, requires usage of the apparatus of quantum mechanics. The basic paradigm of today’s “mainstream” quantum mechanics is the Schrödinger equation. The effort required to solve the Schrödinger equation is heavily dependent on the dimensionality and complexity of the problem itself. Here, we present the Schrödinger API - RESTful web service that provides methods for solution of one-dimensional, two-dimensional and three-dimensional time independent Schrödinger equation based on the the Gauss-Hermite Discrete Variable Representation (DVR) approach. Simple use is ensured thanks to the REST architectural style that uses HTTP requests to access and use data through the website https://schrodinger.chem-api.finki.ukim.mk. The application of the web service is shown by a computational physics use case. Specialists, but also nonexperts in computational chemistry or physics can use this service to support their research.en_US
dc.language.isoenen_US
dc.publisherFaculty of Computer Science and Engineering, Skopje, North Macedoniaen_US
dc.titleSchrödinger API - web service for solving multidimensional time-independent Schrödinger equation using Hermite DVR approachen_US
dc.typeProceeding articleen_US
dc.relation.conference18th Conference for Informatics and Information Technologyen_US
item.grantfulltextopen-
item.fulltextWith Fulltext-
crisitem.author.deptFaculty of Computer Science and Engineering-
crisitem.author.deptFaculty of Computer Science and Engineering-
crisitem.author.deptFaculty of Natural Sciences and Mathematics-
Appears in Collections:Faculty of Computer Science and Engineering: Conference papers
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