Browse Collection: InHfOx_InZrOx InHfOx_InZrOx https://iochem-bd.iciq.es/browse/handle/100/99939 2026-04-14T16:29:51Z 2026-04-14T16:29:51Z /Ab-inito-molecular-dynamics/In(OH)3-t-ZrO2/In(OH)3-t-ZrO2-HCOO In(OH)₃-t-ZrO₂-HCOO-part3 Ritopecki, Milica https://iochem-bd.iciq.es/browse/handle/100/110027 2026-03-02T11:28:28Z 2025-12-02T22:00:29Z Title: /Ab-inito-molecular-dynamics/In(OH)3-t-ZrO2/In(OH)3-t-ZrO2-HCOO In(OH)₃-t-ZrO₂-HCOO-part3 Authors: Ritopecki, Milica Abstract: Ab inito molecular dynamics for In(OH)₃-t-ZrO₂ with one oxygen vacancy and HCOO intermediate, part 3. XDATCAR contains all the steps of AIMD. 2025-12-02T22:00:29Z /Ab-inito-molecular-dynamics/In(OH)3-t-ZrO2/In(OH)3-t-ZrO2-vac In(OH)₃-t-ZrO₂-vac-part4 Ritopecki, Milica https://iochem-bd.iciq.es/browse/handle/100/110026 2026-03-02T11:28:28Z 2025-12-02T22:00:37Z Title: /Ab-inito-molecular-dynamics/In(OH)3-t-ZrO2/In(OH)3-t-ZrO2-vac In(OH)₃-t-ZrO₂-vac-part4 Authors: Ritopecki, Milica Abstract: Ab inito molecular dynamics for In(OH)₃-t-ZrO₂ with one oxygen vacancy, part 4. XDATCAR contains all the steps of AIMD. 2025-12-02T22:00:37Z /Ab-inito-molecular-dynamics/In(OH)3-t-ZrO2/In(OH)3-t-ZrO2-pristine In(OH)₃-t-ZrO₂-pristine-part4 Ritopecki, Milica https://iochem-bd.iciq.es/browse/handle/100/110025 2026-03-02T11:28:28Z 2025-12-02T22:00:40Z Title: /Ab-inito-molecular-dynamics/In(OH)3-t-ZrO2/In(OH)3-t-ZrO2-pristine In(OH)₃-t-ZrO₂-pristine-part4 Authors: Ritopecki, Milica Abstract: Ab inito molecular dynamics for pristine In(OH)₃-t-ZrO₂, part 4. XDATCAR contains all the steps of AIMD. 2025-12-02T22:00:40Z /Ab-inito-molecular-dynamics/In(OH)3-t-ZrO2/In(OH)3-t-ZrO2-CH3O In(OH)₃-t-ZrO₂-CH₃O-part4 Ritopecki, Milica https://iochem-bd.iciq.es/browse/handle/100/110024 2026-03-02T11:28:28Z 2025-12-02T22:00:23Z Title: /Ab-inito-molecular-dynamics/In(OH)3-t-ZrO2/In(OH)3-t-ZrO2-CH3O In(OH)₃-t-ZrO₂-CH₃O-part4 Authors: Ritopecki, Milica Abstract: Ab inito molecular dynamics for In(OH)₃-t-ZrO₂ with one oxygen vacancy and CH₃O intermediate, part 4. XDATCAR contains all the steps of AIMD. 2025-12-02T22:00:23Z