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Chemically Accurate Prediction of CO2 Adsorption Thermodynamics in Metal-Organic Framework CALF-20: Complementary Ab Initio Modeling and Grand Canonical Monte Carlo Simulations
| Title: | Chemically Accurate Prediction of CO2 Adsorption Thermodynamics in Metal-Organic Framework CALF-20: Complementary Ab Initio Modeling and Grand Canonical Monte Carlo Simulations | Authors: | Sillar, Kaido; Grubisic, Sonja   ; Djordjevic, Ivana S ; Hochlaf, Majdi |
Issue Date: | 2026 | Publication: | SMALL STRUCTURES | ISSN: | 2688-4062 Small Structures Search Idenfier |
Type: | Article | Collation: | vol. 7 br. 2 | DOI: | 10.1002/sstr.202500781 | WoS-ID: | 001709833800044 | Scopus-ID: | 2-s2.0-105029128831 | URI: | https://enauka.gov.rs/handle/123456789/1034050 | Project: | Ministarstvo Prosvete, Nauke i Tehnoloscaron kog Razvoja [451-03-136/2025-03/200026] |
Metadata source: | (Preuzeto iz Nasi u WoS) | M-category: | 21aM21a |
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