Matches in SemOpenAlex for { <https://semopenalex.org/work/W2955367458> ?p ?o ?g. }
Showing items 1 to 87 of
87
with 100 items per page.
- W2955367458 endingPage "405" @default.
- W2955367458 startingPage "396" @default.
- W2955367458 abstract "Benzimidazole derivates are investigated the activity of corrosion inhibitor molecules.In quantum chemical calculation, different parameters such as E HOMO , E LUMO , ∆E (HOMO-LUMO energy gap), electronegativity, chemical hardness, global softness, nucleophilicity are calculated by Gaussian 09 software. Studied molecules were performed using the Hartree-Fock (HF) and Becke, 3-parameter, Lee-Yang-Parr (B3LYP) method with sdd, cep-4g, 3-21G, 6-31G, 6-31++G, lanl2dz basis set in gas and aqueous phase. We can see the corrosion inhibitor ranking as: 4NPBI > 4APBI > 2NPBI > 2APBI > 4BPBI > 4MPBI > 4CPBI > PBI in B3lyp method with sdd and lanl2dz." @default.
- W2955367458 created "2019-07-12" @default.
- W2955367458 creator A5013735567 @default.
- W2955367458 date "2019-06-30" @default.
- W2955367458 modified "2023-10-12" @default.
- W2955367458 title "Investigation of Benzimidazole Derivates as Corrosion Inhibitor by DFT" @default.
- W2955367458 cites W1982356449 @default.
- W2955367458 cites W2005877813 @default.
- W2955367458 cites W2023271753 @default.
- W2955367458 cites W2047839134 @default.
- W2955367458 cites W2060955206 @default.
- W2955367458 cites W2070485363 @default.
- W2955367458 cites W2123450981 @default.
- W2955367458 cites W2143981217 @default.
- W2955367458 cites W2281522811 @default.
- W2955367458 cites W2331827140 @default.
- W2955367458 cites W2334263466 @default.
- W2955367458 cites W2343445198 @default.
- W2955367458 cites W2462432576 @default.
- W2955367458 cites W2487645534 @default.
- W2955367458 cites W2611072627 @default.
- W2955367458 cites W2789416967 @default.
- W2955367458 cites W2803189367 @default.
- W2955367458 cites W2894381479 @default.
- W2955367458 cites W4241758615 @default.
- W2955367458 doi "https://doi.org/10.17776/csj.412611" @default.
- W2955367458 hasPublicationYear "2019" @default.
- W2955367458 type Work @default.
- W2955367458 sameAs 2955367458 @default.
- W2955367458 citedByCount "13" @default.
- W2955367458 countsByYear W29553674582019 @default.
- W2955367458 countsByYear W29553674582020 @default.
- W2955367458 countsByYear W29553674582021 @default.
- W2955367458 countsByYear W29553674582022 @default.
- W2955367458 crossrefType "journal-article" @default.
- W2955367458 hasAuthorship W2955367458A5013735567 @default.
- W2955367458 hasBestOaLocation W29553674581 @default.
- W2955367458 hasConcept C14158195 @default.
- W2955367458 hasConcept C147597530 @default.
- W2955367458 hasConcept C147789679 @default.
- W2955367458 hasConcept C152365726 @default.
- W2955367458 hasConcept C161790260 @default.
- W2955367458 hasConcept C177293861 @default.
- W2955367458 hasConcept C178790620 @default.
- W2955367458 hasConcept C178907741 @default.
- W2955367458 hasConcept C185592680 @default.
- W2955367458 hasConcept C20625102 @default.
- W2955367458 hasConcept C2777145204 @default.
- W2955367458 hasConcept C2778484023 @default.
- W2955367458 hasConcept C32909587 @default.
- W2955367458 hasConcept C65956243 @default.
- W2955367458 hasConceptScore W2955367458C14158195 @default.
- W2955367458 hasConceptScore W2955367458C147597530 @default.
- W2955367458 hasConceptScore W2955367458C147789679 @default.
- W2955367458 hasConceptScore W2955367458C152365726 @default.
- W2955367458 hasConceptScore W2955367458C161790260 @default.
- W2955367458 hasConceptScore W2955367458C177293861 @default.
- W2955367458 hasConceptScore W2955367458C178790620 @default.
- W2955367458 hasConceptScore W2955367458C178907741 @default.
- W2955367458 hasConceptScore W2955367458C185592680 @default.
- W2955367458 hasConceptScore W2955367458C20625102 @default.
- W2955367458 hasConceptScore W2955367458C2777145204 @default.
- W2955367458 hasConceptScore W2955367458C2778484023 @default.
- W2955367458 hasConceptScore W2955367458C32909587 @default.
- W2955367458 hasConceptScore W2955367458C65956243 @default.
- W2955367458 hasIssue "2" @default.
- W2955367458 hasLocation W29553674581 @default.
- W2955367458 hasLocation W29553674582 @default.
- W2955367458 hasOpenAccess W2955367458 @default.
- W2955367458 hasPrimaryLocation W29553674581 @default.
- W2955367458 hasRelatedWork W2131238432 @default.
- W2955367458 hasRelatedWork W2298746276 @default.
- W2955367458 hasRelatedWork W2602441319 @default.
- W2955367458 hasRelatedWork W2606898376 @default.
- W2955367458 hasRelatedWork W2955367458 @default.
- W2955367458 hasRelatedWork W3211876125 @default.
- W2955367458 hasRelatedWork W4200452848 @default.
- W2955367458 hasRelatedWork W4205178407 @default.
- W2955367458 hasRelatedWork W4297034793 @default.
- W2955367458 hasRelatedWork W4312075954 @default.
- W2955367458 hasVolume "40" @default.
- W2955367458 isParatext "false" @default.
- W2955367458 isRetracted "false" @default.
- W2955367458 magId "2955367458" @default.
- W2955367458 workType "article" @default.