Works matching DE "DENSITY functional theory"
1
- International Journal of Computational Materials Science & Engineering, 2025, v. 14, n. 3, p. 1, doi. 10.1142/S2047684123500562
- Elakia, M.;
- Sarath Kumar, C. B.;
- Reji, Rence P.;
- Sivalingam, Y.;
- Surya, V. J.
- Article
2
- International Journal of Computational Materials Science & Engineering, 2025, v. 14, n. 3, p. 1, doi. 10.1142/S2047684123500525
- Sahar, Muhammad Sana Ullah;
- Ali, Syed Mansoor;
- Junaid Zaidi, S. M.;
- Zafar Iqbal, Syed M.;
- Shahid, Mubeen;
- Khan, M. Ijaz
- Article
3
- International Journal of Computational Materials Science & Engineering, 2025, v. 14, n. 3, p. 1, doi. 10.1142/S2047684123500513
- Article
4
- Biochemistry Research International, 2025, v. 2025, p. 1, doi. 10.1155/bri/7961294
- Shehab, Wesam S.;
- Mohammed, Jalal Hasan;
- Magdy, Naja;
- Zordok, Wael A.;
- Jaremko, Mariusz;
- Elsayed, Doaa A.;
- Khatra, Harleen
- Article
5
- Journal of Computer-Aided Molecular Design, 2025, v. 39, n. 1, p. 1, doi. 10.1007/s10822-025-00644-x
- Ben Khemis, Ismahene;
- Gassoumi, Bouzid;
- Aouaini, Fatma;
- Knani, Salah;
- Graba, Besma;
- Albadrani, Ghadeer Mohsen;
- Ben Lamine, Abdelmottaleb
- Article
6
- Chemistry - A European Journal, 2025, v. 31, n. 44, p. 1, doi. 10.1002/chem.202502197
- Pearce, Kyle G.;
- Morales, Agustín;
- Hill, Michael S.;
- McMullin, Claire L.
- Article
7
- Chemistry - A European Journal, 2025, v. 31, n. 44, p. 1, doi. 10.1002/chem.202502029
- Ohms, Leon;
- Schmidt, Pascal;
- Surkau, Jonas;
- Bresien, Jonas;
- Schulz, Axel
- Article
8
- Chemistry - A European Journal, 2025, v. 31, n. 44, p. 1, doi. 10.1002/chem.202501777
- Ouyang, Jinbo;
- Jiang, Longping;
- Li, Jiayao;
- He, Feiqiang;
- Gao, Zhi;
- Wang, Mengmeng;
- Zhou, Limin;
- Xie, Zongbo;
- Zhu, Zhiqiang;
- Chen, Yifu
- Article
9
- Angewandte Chemie, 2025, v. 137, n. 33, p. 1, doi. 10.1002/ange.202510744
- Statham, Benjamin J.;
- Mulks, Florian F.;
- Bolm, Carsten
- Article
10
- Angewandte Chemie, 2025, v. 137, n. 33, p. 1, doi. 10.1002/ange.202510209
- Lión‐Villar, Juan;
- Torchon, Herdya S.;
- Zhu, Yikun;
- Wei, Zheng;
- Fernández‐García, Jesús M.;
- Fernández, Israel;
- Petrukhina, Marina A.;
- Martín, Nazario
- Article
11
- Angewandte Chemie, 2025, v. 137, n. 33, p. 1, doi. 10.1002/ange.202509754
- Kayahara, Eiichi;
- Okahara, Ryota;
- Shibata, Amiri;
- Abe, Manabu;
- Yamago, Shigeru
- Article
12
- Angewandte Chemie, 2025, v. 137, n. 33, p. 1, doi. 10.1002/ange.202507590
- Zhou, Jin‐Lan;
- Zhan, Xuan;
- He, Heng‐Xian;
- Xu, Youzhi;
- Peng, Quanxin;
- Huang, Genping;
- Feng, Jian‐Jun
- Article
13
- Angewandte Chemie, 2025, v. 137, n. 33, p. 1, doi. 10.1002/ange.202507468
- Han, Xue;
- Mou, Tianyou;
- Kang, Sinwoo;
- Islam, Arephin;
- Zhao, Xueru;
- Sasaki, Kotaro;
- Rodriguez, José A.;
- Chang, Qiaowan;
- Liu, Ping;
- Chen, Jingguang G.
- Article
14
- Angewandte Chemie, 2025, v. 137, n. 33, p. 1, doi. 10.1002/ange.202507040
- Zhang, Xiao‐Han;
- Zhang, Meng‐Tian;
- Du, Hong‐Gang;
- Huang, Hai‐Hua;
- Zhang, Xue‐Feng;
- Wen, Xia;
- Wang, Li‐Dong;
- Deng, Wei‐Zhen;
- He, Yu‐Mei;
- Bai, Jie;
- Ding, Li‐Wen;
- He, Chun‐Ting
- Article
15
- Advanced Functional Materials, 2025, v. 35, n. 32, p. 1, doi. 10.1002/adfm.202502952
- Xu, Hongyi;
- Liu, Minjie;
- Huang, Letian;
- Zhang, Xiao;
- Ma, Zheng;
- Zhu, Chunling;
- Cao, Fenghui;
- Chen, Yujin
- Article
16
- Advanced Functional Materials, 2025, v. 35, n. 32, p. 1, doi. 10.1002/adfm.202501488
- Hu, Deng;
- Luo, Hang;
- Guo, Ru;
- He, Guanghu;
- Wang, Fan;
- Li, Xiaona;
- Peng, Bo;
- Wang, Huan;
- Peng, Jiajun;
- Zhang, Dou
- Article
17
- Journal of Materials Science: Materials in Electronics, 2025, v. 36, n. 23, p. 1, doi. 10.1007/s10854-025-15452-0
- Zaki, M. F.;
- Rashad, A. M.;
- Elshaer, Y. H.;
- El-Kareem, Mamoun S. M. Abd;
- Abdallah, Asmaa S.;
- Elkalashy, Sh. I.
- Article
18
- Journal of Materials Science, 2025, v. 60, n. 31, p. 13191, doi. 10.1007/s10853-025-11190-0
- Hasan, Mohammed Abdulabbas;
- Abdulhussein, Heider A.
- Article
19
- Journal of Electronic Materials, 2025, v. 54, n. 9, p. 7609, doi. 10.1007/s11664-025-12179-w
- Chen, Lin;
- Li, Haixia;
- Chen, Shangju
- Article
20
- Journal of Electronic Materials, 2025, v. 54, n. 9, p. 7027, doi. 10.1007/s11664-025-12152-7
- Shaheen, S. M.;
- Iqbal, Shahid;
- Ali, Amjad;
- Ahmad, Naushad;
- Nawaz, Muhammad Asif;
- Rafique, Muhammad;
- Rehman, A.;
- Tufail, Muhammad Khurram
- Article
21
- Journal of Electronic Materials, 2025, v. 54, n. 9, p. 7573, doi. 10.1007/s11664-025-12090-4
- Menad, A.;
- Boutaiba, F.;
- Ferhat, M.
- Article
22
- Journal of Electronic Materials, 2025, v. 54, n. 9, p. 7557, doi. 10.1007/s11664-025-12085-1
- Yu, Dongling;
- Zhu, Liangyu;
- Cui, Xiaobin;
- Ning, Xiang;
- Li, Jiao;
- Liao, Dahai
- Article
23
- Advanced Materials Interfaces, 2025, v. 12, n. 15, p. 1, doi. 10.1002/admi.202500010
- Saputera, Wibawa Hendra;
- Satriyatama, Adhi;
- Budi, Ignatius Dozy Mahatmanto;
- Saputro, Adhitya Gandaryus;
- Mahyuddin, Muhammad Haris;
- Utomo, Wahyu Prasetyo;
- Mutiara, Siska;
- Chung, Hoi Ying;
- Arramel;
- Abdi, Fatwa Firdaus;
- Sasongko, Dwiwahju
- Article
24
- Chinese Journal of High Pressure Physics, 2025, v. 39, n. 8, p. 1, doi. 10.11858/gywlxb.20251028
- 徐 威;
- 亓文明;
- 阿布都吾甫尔, 海迪且木;
- 鹿桂花;
- 卫 来;
- 李 鹏;
- 高 敏
- Article
25
- Journal of Computational Biophysics & Chemistry, 2026, v. 25, n. 6, p. 919, doi. 10.1142/S2737416525500759
- Velmurugan, Pavithra;
- Shankari, Gopalakrishnan;
- Ganapathi, Haema;
- Moovarkumudalvan, Balasubramanian;
- Saravanan, Suresh Kumar;
- Kumar, Vinay;
- Rajamanikandan, Sundararaj;
- Subramanyam, Veni
- Article
26
- Journal of Computational Biophysics & Chemistry, 2026, v. 25, n. 6, p. 835, doi. 10.1142/S2737416525500711
- Shuvo, Mahmudul Hasan;
- Hossain, Md. Shohel;
- Noyon, M. R. O. Khan;
- Maria, Mustary Anjum;
- Tahcin, Anika;
- Ibban, Sadab Sipar;
- Shimu, Sharmin Sultana;
- Hasan, Md Kamrul;
- Naima, Jannatul;
- Uzzaman, Monir
- Article
27
- Journal of Computational Biophysics & Chemistry, 2026, v. 25, n. 5, p. 769, doi. 10.1142/S273741652550067X
- Iqbal, Azhar;
- Fatima, Zunaira;
- Ali, Faisal;
- Zafar, Fatima;
- Bibi, Shabana;
- Sajid, Muhammad;
- Albadrani, Ghadeer M.;
- Al-Ghadi, Muath Q.;
- Sayed, Amany A.;
- Abdel-Daim, Mohamed M.
- Article
28
- Journal of Computational Biophysics & Chemistry, 2026, v. 25, n. 5, p. 685, doi. 10.1142/S2737416525500632
- Shahab, Nazish;
- Alam, Aftab;
- Elhenawy, Ahmed A.;
- Ayaz, Muhammad;
- Khan, Momin;
- Rehman, Najeeb Ur;
- Talab, Faiz;
- Al-Harrasi, Ahmed;
- Latif, Abdul;
- Ali, Mumtaz;
- Ahmad, Manzoor
- Article
29
- Journal of Zhengzhou University (Natural Science Edition), 2025, v. 57, n. 6, p. 83, doi. 10.13705/j.issn.1671-6841.2024037
- Article
30
- Chemistry - A European Journal, 2025, v. 31, n. 42, p. 1, doi. 10.1002/chem.202501864
- Teichmanová, Kateřina;
- Luňák, Stanislav;
- Pauk, Karel;
- Střižík, Lukáš;
- Růžičková, Zdeňka;
- Mikysek, Tomáš;
- Melánová, Klára;
- Imramovský, Aleš;
- Nagura, Kazuhiko
- Article
31
- ChemSusChem, 2025, v. 18, n. 16, p. 1, doi. 10.1002/cssc.202501040
- Mandal, Subhankar;
- Parida, Sanjukta;
- Mishra, Sabyashachi;
- Bhattacharyya, Aninda J.
- Article
32
- ChemCatChem, 2025, v. 17, n. 15, p. 1, doi. 10.1002/cctc.202500312
- Ren, Jingjing;
- Launay, Franck;
- Villanneau, Richard;
- Gérard, Hélène
- Article
33
- NPJ 2D Materials & Applications, 2025, v. 9, n. 1, p. 1, doi. 10.1038/s41699-025-00590-0
- Seeyangnok, Jakkapat;
- Pinsook, Udomsilp;
- Ackland, Graeme J.
- Article
34
- Scientific Data, 2025, v. 12, n. 1, p. 1, doi. 10.1038/s41597-025-05729-8
- Zipoli, Federico;
- Alberts, Marvin;
- Laino, Teodoro
- Article
35
- University of Thi-Qar Journal of Science, 2025, v. 12, n. 1, p. 224, doi. 10.32792/utq/utjsci/v12i1.1393
- Ali, Noora H.;
- Al-Badry, Lafy F.;
- Ahmed, Ali Ben
- Article
36
- Scientific Reports, 2025, v. 15, n. 1, p. 1, doi. 10.1038/s41598-025-14535-6
- R., Saswathy;
- Ali, Mohamad Akbar
- Article
37
- Scientific Reports, 2025, v. 15, n. 1, p. 1, doi. 10.1038/s41598-025-13307-6
- El-Sheikh, Abdel Salam;
- Abdelaziz, Nabil S.;
- Amin, Khaled S.;
- Elhaes, Hanan;
- Ibrahim, Medhat A.
- Article
38
- Canadian Journal of Chemistry, 2025, v. 103, n. 8, p. 435, doi. 10.1139/cjc-2024-0211
- Ardjani, Taki Eddine Ahmed;
- Alvarez-Idaboy, Juan Raul
- Article
39
- CET Journal - Chemical Engineering Transactions, 2025, v. 117, p. 409, doi. 10.3303/CET25117069
- Arif, Muhammad Bilal;
- Coquelet, Christophe;
- Jacquier, Frank;
- Adamo, Carlo;
- Lacuve, Maxime;
- Calvet, Rachel
- Article
40
- Journal of Computer-Aided Molecular Design, 2025, v. 39, n. 1, p. 1, doi. 10.1007/s10822-025-00634-z
- Soni, Sanjay;
- Patil, Khushbu;
- Gavale, Sharad;
- Pathan, Soyeb;
- Yadav, Rasana;
- Murumkar, Prashant R.;
- Kadu, Rahul
- Article
41
- Small Structures, 2025, v. 6, n. 8, p. 1, doi. 10.1002/sstr.202500048
- Lee, June Ho;
- Kim, Jaeseon;
- Park, Youngjun;
- Shin, Yonghun;
- Kim, Eun Ho;
- Lee, Donghwa
- Article
42
- Environmental Science & Pollution Research, 2025, v. 32, n. 30, p. 18025, doi. 10.1007/s11356-025-36679-8
- EL Azizi, Amine;
- Hamidallah, Konouz;
- Chahid, Ayoub;
- EL Harouachi, Hanane;
- Maliki, Soundouss;
- Elsenety, Mohamed;
- Ahoudi, Dounia;
- Loutou, Mohamed
- Article
43
- Arabian Journal of Chemistry, 2025, v. 18, n. 7, p. 1, doi. 10.25259/AJC_162_2024
- Article
44
- Arabian Journal of Chemistry, 2025, v. 18, n. 7, p. 1, doi. 10.25259/AJC_242_2024
- James, J. Jeni;
- Amalanathan, M.;
- Kumar, N. Sheen;
- Mary, M. Sony Michael;
- Manoj, D. Shiney;
- Sillanpää, Mika;
- Al-Farra, Saleh;
- Rani, S. Deepa;
- Seema, A.
- Article
45
- Arabian Journal of Chemistry, 2025, v. 18, n. 6, p. 1, doi. 10.25259/AJC_183_2025
- Altamimi, Abdulmalik S. A.
- Article
46
- Arabian Journal of Chemistry, 2025, v. 18, n. 5, p. 1, doi. 10.25259/AJC_32_2025
- Riadi, Yassine;
- Geesi, Mohammed H.
- Article
47
- Arabian Journal of Chemistry, 2025, v. 18, n. 4, p. 1, doi. 10.25259/AJC_56_2025
- Abou-Melha, Khlood Saad A.
- Article
48
- Arabian Journal of Chemistry, 2025, v. 18, n. 2, p. 1, doi. 10.25259/AJC_38_2024
- Lgaz, Hassane;
- Al-Qurashi, Ohoud S;
- Wazzan, Nuha
- Article
49
- Journal of Structural Chemistry, 2025, v. 66, n. 7, p. 1412, doi. 10.1134/S002247662507008X
- Goloveshkin, A. S.;
- Sheverdina, K. M.;
- Naumkin, A. V.;
- Golub, A. S.
- Article
50
- Russian Journal of General Chemistry, 2025, v. 95, n. 7, p. 1736, doi. 10.1134/S107036322560184X
- Smirnov, A. V.;
- Diniakhmetova, D. R.;
- Kolesov, S. V.
- Article