Year:  2023 |  2022  |  2021  |  2020


No. Title Author(s)
51 Enhancing Oxygen Reduction Reaction Activity of Pyrolyzed FeN-C Catalyst by the Inclusion of BN Dopant at the Graphitic Edges
Applied Surface Science, 155203.
ISSN: 0169-4332
DOI: 10.1016/j.apsusc.2022.155203
Nuruddin, A.; Saputro, A. G. ; Maulana, A. L.; Fajrial, A. K.; Shukri, G.; Mahyuddin, M. H.; Aprilyanti, F. D.; Harimawan, A.; Dipojono, H. K.


No. Title Author(s)
50 Tailoring the Optical and Electronic Properties of 2D Hybrid Dion-Jacobson Copper Chloride Perovskites
The Journal of Physical Chemistry C, Accepted
ISSN: 1932-7447
DOI: 10.1021/acs.jpcc.2c06050
Mahyuddin, M.H.; Arramel, Diguna, L.J.; Agusta, M.K.; Mulyani, I.; Onggo, D.; Shiddiq, M.; Tang, C.S.; Diao. C.; Dang, C.; Birowosuto, M. D.; Wee, A. T. S.;  Rusydi, A.
49 Small-pore Zeolite and Zeotype Membranes for CO2 Capture and Sequestration – A Review
Journal of Environmental Chemical Engineering, 108707
ISSN: 2213-3437
Rahmah, Widda; Kadja, Grandprix T. M.; Mahyuddin, M.H.; Saputro, A.G.; Dipojono, H.K.; Wenten, I.G.
48 Palm Sugar-Induced Formation of Hexagonal Tungsten Oxide with Nanorods-Assembled Three-Dimensional Hierarchical Frameworks for Nitrogen Dioxide Sensing
ACS Sustainable Chemistry & Engineering, Accepted.
ISSN: 2168-0485
Septiani, N.L.W.; Shukri, G.; Saputro, A.G.; Nugraha; Karim, M.R.; Al-Mubaddel, F.; Hardiansyah, A.; Yamauchi, Y.; Kaneti, Y. V.; Yuliarto, B.
47 Anisotropic Li diffusion in pristine and defective ZnO bulk and (1010) surface
Solid State Ionics, 385, 2022, 116025
ISSN: 0167-2738
DOI: 10.1016/j.ssi.2022.116025
Shukri, G.; Saputro, A. G. ; Tarabunga, P.S.; Panjaitan, F.V.; Agusta, M. K.; Nuruddin, A.; Dipojono, H. K.
46 Photodetection and Scintillation Characterizations of Novel Lead-Bismuth Double Perovskite Halides
Journal of Materials Chemistry C, 10, 31, 11266-11275
ISSN: 2050-7534
DOI: 10.1039/D2TC01646J
Maddalena, F.; Witkowski, M.; Makowski, M.; Bachiri, A.; Arramel; Yang, T.; Mahyuddin, M.H.; Baravaglio, M.; Boutchich, M.; Drozdowski, W.; Dujardin, C.; Birowosuto, M.D.; Dang, C.
45 BA2XBr4 (X = Pb, Cu, Sn): From Lead to Lead-Free Halide Perovskite Scintillators
Materials Advances, 3, 12, 5087-5095
ISSN: 2633-5409
DOI: 10.1039/D2MA00258B
Diguna, L.J.; Jonathan, L.; Mahyuddin, M.H.; Arramel; Maddalena, F.; Mulyani, I.; Onggo, D.; Bachiri, A.; Witkowski, M.E.; Makowski, M.; Kowal, D.; Drozdowski, W.; Birowosuto, M.D.
44 Design of a Single Split-Ring Resonator-based Microwave Metamaterial for Detection of the Composition of Vegetable Oil and Gasoline Mixtures
Journal of Materials Science: Materials in Electronics, 33, 8151-8158
ISSN: 0957-4522
DOI: 10.1007/s10854-022-07964-w
Sopian, O.; Yudistira, H.T.; Qalbina, F.; Prahmana, R.A.; Saputro, A.G.;  Faisal, A.
43 Enhanced Lithium Diffusivity in Reduced Cerium Oxides: A First-Principles Study
The Journal of Physical Chemistry C, 126, 7, 3328–3338
ISSN: 1932-7447
DOI: 10.1021/acs.jpcc.1c09032
Komalig, R.W.K.; Shukri, G.; Agusta, M.K.Saputro, A.G.; Sumboja, A.; Nuruddin, A.; Dipojono, H.K.
42 Molecular Insight into the Role of Zeolite Lattice Constraints on Methane Activation over Cu-O-Cu Active Site
(selected as a 2022 HOT PCCP Article)

Physical Chemistry Chemical Physics, 24, 7, 4196-4203
ISSN: 1463-9076
DOI: 10.1039/D1CP05371J
Mahyuddin, M.H.; Saputro, A.G.; Sukanli, R.P.P.; Fathurrahman, F.; Rizkiana, J.; Nuruddin, A.; Dipojono, H.K.
41 The Role of Disaccharides as a Plasticizer in Improving Interaction between Chitosan Chains based Solid Polymer Electrolytes (SPEs)
New Journal of Chemistry, 46, 8, 3844-3855
ISSN: 1144-0546
DOI: 10.1039/D1NJ05735A
Ra’il, N.H.; Saputro, A.G.; N. Ataollahi; Ahmad, A.; Mobarak, N.N.
40 Ethylene Carbonate Adsorption and Decomposition on Pristine and Defective ZnO (101̅0) Surface: A First-Principles Study
The Journal of Physical Chemistry C, 126, 4, 2151–2160
ISSN: 1932-7447
DOI: 10.1021/acs.jpcc.1c09244
Shukri, G.; Rendy, B.; Saputro, A.G.; Panjaitan, F. ; Tarabunga, P. ; Agusta, M.K.; Mobarak, N.N.; Dipojono, H.K.
39 Temperature-Induced Orbital Polarizations and Tunabel Charge Dynamics in Layered Double Perovskites Thin Films
Materials Today Energy, 24, 100921
ISSN: 1369-7021
DOI: 10.1016/j.mtener.2021.100921
Arramel; Maddalena, F.; Mahyuddin, M.H.; Yin, X.; Tang, C.S.; Agusta, M.K.; Sahdan, M.F.; Diao. C.; Dang, C.; Birowosuto, M. D.; Wee, A. T. S.;  Rusydi, A.


No. Title Author(s)
38 Noise Attenuation of a Duct-resonator System Using Coupled Helmholtz Resonator – Thin Flexible Structures
Journal of Engineering and Technological Sciences, 53, 6, 210605
ISSN: 2337-5779
DOI: 10.5614/j.eng.technol.sci.2021.53.6.5
Prasetiyo, I.; Desendra, G.; Khoerul, A.; Agusta, M.K.
37 Conservation of correlation in measurements underlying the violation of Bell inequalities and a game of joint mapping
Physical Review A, 104, 052226
ISSN: 1050-2947
DOI: 10.1103/PhysRevA.104.052226
Budiyono, A.
36 Accelerated, mesoporogen-free synthesis of hierarchical nanorod ZSM-48 assisted by hydroxyl radicals
Industrial & Engineering Chemistry Research, 60, 48, 17786–17791
ISSN: 0888-5885
DOI: 10.1021/acs.iecr.1c03586
Kadja, G.T.M.; Azhari, N.J.; Mardiana, S.; Khalil, M.; Subagjo; Mahyuddin, M.H.
35 Multilayer Flexible Metamaterials Based on Circular Shape with Negative Refractive Index at Microwave Spectrum
Sensors and Actuators, Vol. 332, No. 113208
ISSN: 0924-4247
DOI: 10.1016/j.sna.2021.113208
Rasad, A.; Yudistira, H.T.; Qalbina, F; Saputro, A.G.; Faisal, A.
34 Coadsorption of Hydrazine and OH on the Ni(211) Surface: A DFT Study
Surface Science, Vol. 714, No. 121931
ISSN: 0039-6028
DOI: 10.1016/j.susc.2021.121931
Hidayat, N.N.; Agusta, M.K.; Dipojono, H.K.; Nakanishi, H.; Kasai, H.
33 Formation of Tilted FeN4 Configuration as the Origin of Oxygen Reduction Reaction Activity Enhancement on Pyrolyzed Fe-N-C Catalyst with FeN4-Edge Active Sites
The Journal of Physical Chemistry C, 125, 36, 19682–19696
ISSN: 1932-7447
DOI: 10.1021/acs.jpcc.1c04094
Saputro, A.G.; Maulana, A.L.; Fathurrahman, F.; Mahyuddin, M.H.; Agusta, M.K.; Shukri, G.; Yudistira, H.T.; Wenten, I.G.; Dipojono, H.K.
32 Two-electron Electrochemical Reduction of CO2 on B-doped Ni-N-C Catalysts: A First-principles Study
The Journal of Physical Chemistry C, 125, 35, 19247-19258
ISSN: 1932-7447
DOI: 10.1021/acs.jpcc.1c04986
Maulana, A.L.; Saputro, A.G.; Prasetyo, Y.; Mahyuddin, M.H.; Iqbal, M.; Yudistira, H.T.; Wenten, I.G.; Dipojono, H.K.
31 Distinct Behaviors of Cu- and Ni-ZSM-5 Zeolites Toward the Post-Activation Reactions of Methane
The Journal of Physical Chemistry C, 125, 35, 19333-19344
ISSN: 1932-7447
DOI: 10.1021/acs.jpcc.1c06400
Mahyuddin, M.H.; Tanaka, S.; Kitagawa, R.; Maulana, A.L.; Saputro, A.G.; Agusta, M.K.; Yudistira, H.T.; Dipojono, H.K.; Yoshizawa, K.
30 O—H and C—H bond dissociations in non-phenyl and phenyl groups: A DFT study with dispersion and long-range corrections
Theoretical Chemistry Accounts, Vol. 140, No. 94
ISSN: 1432-2234
DOI: 10.1007/s00214-021-02781-6
Boli, L.S.P.; Rusydi, F.; Khoirunisa, V.; Puspitasari, I.; Rachmawati, H.; Dipojono, H.K.
29 Ligand Size Effects in Two-Dimensional Hybrid Copper Halide Perovskites Crystals
Communications Materials, Vol. 2, No. 70
ISSN: 2662-4443
DOI: 10.1038/s43246-021-00175-6

Arramel, Fauzi, A. D.; Yin, X.; Tang, C. S.; Mahyuddin, M. H.; Sahdan, M. F.;  Aminah, M.; Onggo, D.; Shukri, G.; Diao, C.; Wang, H.; Birowosuto, M. D.; Wee, A. T. S.;  Rusydi, A.

28 Scintillation in (C6H5CH2NH3)2SnBr4: Green-Emitting Lead-Free Perovskite Halide Materials
RSC Advances, 11, 34, 20635-20640
ISSN: 2046-2069
DOI: 10.1039/D1RA01123E
Diguna, L. J.; Kaffah, S.; Mahyuddin, M. H.; Arramel, Maddalena, F.; Suriani, A. B.; Aminah, M.; Onggo, D.; Witkowski, M. E.; Makowski, M.; Drozdowski, W.; Birowosuto, M. D.
27 Computational Investigation on the ∙OOH Scavenging Sites of Gnetin C
Foods Biophysics, Accepted
ISSN: 1557-1858
DOI: 10.1007/s11483-021-09666-y
Khoirunisa, V.; Rusydi, F.; Boli, L.S.P.; Saputro, A.G.; Rachmawati, H.; Nakanishi, H.; Kasai, H.; Dipojono, H.K.
26 Theoretical Study of Direct Carbon Dioxide Conversion to Formic Acid on Transition Metal-Doped Subnanometer Palladium Cluster
Journal of Engineering and Technological Sciences, Vol. 53, No. 4
ISSN: 2337-5779
DOI: 10.5614/j.eng.technol.sci.2021.53.4.2
Saputro, A.G.; Maulana, A.L.; Aprilyanti, F.D.; Dipojono, H.K.
25 Significant Role of Thorny Surface Morphology of Polyaniline on Adsorption of Triiodide Ions towards Counter Electrode in Dye-Sensitized Solar Cells
New Journal of Chemistry, Vol. 45, Issue 13, 5958-5970
ISSN: 1144-0546 (print) 1369-9261 (web)
DOI: 10.1039/D0NJ06180H
Reza, M.; Utami, A.N.; Amalina, A.N.; Benu, D.P.; Fatya, A.I.; Agusta, M.K.; Yuliarto, B.Y.; Kaneti, Y.; Ide, Y.; Yamauchi, Y.; Suendo, V.
24 Effect of polyethylene glycol 6000 on the microstructure and magnetic properties of BaFe10.4Al1.6O19
Materials Research Express, Vol. 8, No. 3, 036102
ISSN: 2053-1591
DOI: 10.1088/2053-1591/abe9d2
Nuruddin, A.; Diba, F.F.; Saputro, A.G.; Yuliarto, B.; Ramelan, A.
23 Solvent-free, small organic lactam-assisted synthesis of ZSM-5 zeolites
Materials Letters, Vol. 290, No. 129501
ISSN: 0167-577X
DOI: 10.1016/j.matlet.2021.129501
Kadja, G.T.M; Rukmana, M.D.; Mukti, R.R.; Mahyuddin, M.H.; Saputro, A.G.; Wungu, T.D.K.
22 Density Functional and Microkinetic Study of CO2 Hydrogenation to Methanol on Subnanometer Pd Cluster Doped by Transition Metal (M= Cu, Ni, Pt, Rh)
International Journal of Hydrogen Energy, Vol. 46, Issue 27, 14418-14428
ISSN: 0360-3199
DOI: 10.1016/j.ijhydene.2021.02.009
Saputro, A.G.; Maulana, A.L.; Fathurrahman, F.; Shukri, G.;  Mahyuddin, M.H.; Agusta, M.K.; Wungu, T.D.K.; Dipojono, H.K.


No. Title Author(s)
21 Estimation independence as an axiom for quantum uncertainty
Physical Review A, 101, 022102
ISSN: 1050-2947
DOI: 10.1103/PhysRevA.101.022102
Budiyono, A.
20 Tunable Concave Surface Features of Mesoporous Palladium Nanocrystals Prepared from Supramolecular Micellar Templates
ACS Applied Materials and Interfaces, Vol. 12, No. 46, 51357–51365
ISSN: 1944-8244
DOI: 10.1021/acsami.0c13136
Iqbal, M.; Kim, Y.;  Saputro, A.G.; Shukri, G.; Yuliarto, B.; Lim, H.; Nara, H.; Alothman, A.A.; Na, J.; Bando, Y.; Yamauchi, Y.
19 Oxidative Activation of Metal-Exchanged Zeolite Catalysts for Methane Hydroxylation
in Direct Hydroxylation of Methane (K. Yoshizawa Ed.), Springer Nature
ISBN: 978-981-15-6985-2
DOI: 10.1007/978-981-15-6986-9_5
Mahyuddin, M.H.
18 Mechanistic Understanding of Methane Hydroxylation by Cu-Exchanged Zeolites
in Direct Hydroxylation of Methane (K. Yoshizawa Ed.), Springer Nature
ISBN: 978-981-15-6985-2
DOI: 10.1007/978-981-15-6986-9_4
Mahyuddin, M.H.; Dipojono, H.K.; Yoshizawa, K.
17 Efficient classical computation of expectation values in a class of quantum circuits with an epistemically restricted phase space representation
Scientific Reports, Vol. 10, No. 14769
ISSN: 2045-2322
DOI: 10.1038/s41598-020-71836-8
Budiyono, A.; Dipojono, H.K.
16 Nonlinear Schrödinger equations and generalized Heisenberg uncertainty principle from estimation schemes violating the principle of estimation independence
Physical Review A, Vol. 102, No. 012205
ISSN: 2469-9926
DOI: 10.1103/PhysRevA.102.012205
Budiyono, A.; Dipojono, H.K.
15 Holey assembly of two‐dimensional iron‐doped nickel‐cobalt layered double hydroxide nanosheets for energy conversion application
ChemSusChem, Vol. 13, No. 6, Page 1645
ISSN: 1864-5631
DOI: 10.1002/cssc.201901364
Septiani, N.L.W.; Kaneti, Y.V.; Guo, Y.; Yuliarto, B.; Jiang, X.; Ide, Y.; Nugraha; Dipojono, H.K.; Yu, A.; Sugahara, Y.; Golberg, D.; Yamauchi, Y.
14 Self-Assembly of Two-Dimensional Bimetallic Nickel–Cobalt Phosphate Nanoplates into One-Dimensional Porous Chainlike Architecture for Efficient Oxygen Evolution Reaction
Chemistry of Materials, Volume 32, Issue 16, 7005-7018
ISSN: 0897-4756
DOI: 10.1021/acs.chemmater.0c02385
Septiani, N. L. W.;  Kaneti, Y. V.;  Fathoni, K. B.;  Kani, K.;  Allah, A. E.;  Yuliarto, B.;  Nugraha;  Dipojono, H. K.;  Alothman, Z. A.;  Golberg, D.; Yamauchi, Y.
13 Tailorable nanoarchitecturing of bimetallic nickel–cobalt hydrogen phosphate via the self-weaving of nanotubes for efficient oxygen evolution
Journal of Materials Chemistry A, Volume 8, Issue 6, 3035-3047
ISSN: 2050-7488
DOI: 10.1039/C9TA13442E
Septiani, N. L. W.;  Kaneti, Y. V.;  Fathoni, K. B.;  Guo, Y.;  Ide, Y.;  Yuliarto, B.;  Jiang, X.;  Nugraha;  Dipojono, H. K.;  Golberg, D.; Yamauchi, Y.
12 Hollow Zinc Oxide Microsphere-Multiwalled Carbon Nanotubes Composites for Selective Detection of Sulfur Dioxide
ACS Applied Nano Materials, Volume 3, Issue 9, 8982–8996
ISSN: 2574-0970
DOI: 10.1021/acsanm.0c01707
Septiani, N. L. W.;  Saputro, A. G.;  Kaneti, Y. V.;  Maulana, A. L.;  Fathurrahman, F.;  Lim, H.;  Yuliarto, B.;  Nugraha;  Dipojono, H. K.;  Golberg, D.; Yamauchi, Y.
11 Molecular Functionalization of All-Inorganic Perovskite CsPbBr3 Thin Films
Journal of Materials Chemistry C, Volume 8, Issue 36, Page 12587
ISSN: 2050-7534
DOI: 10.1039/D0TC02642E
Arramel, Hu, P., Xie, A., Yin, X., Tang, C. S., Ikeda, K., Mahyuddin, M. H., Sahdan, M. F., Wang, D., Yoshizawa, K., Birowosuto, M. D., Wang, H., Dang, C.,  Rusydi, A., Wee, A. T. S., Wu, J.
10 Electronic and Optical Modulation of Metal-Doped Hybrid Organic-Inorganic Perovskites Crystals by Post-Treatment Control
ACS Applied Energy Materials, Volume 3, Issue 8, Page 7500
ISSN: 2574-0962
DOI: 10.1021/acsaem.0c00916
Arramel, Xie, A., Yin, X., Tang, C. S., Mahyuddin, M. H., Hettiarachchi, C., Sahdan, M. F., Yoshizawa, K., Dang, C., Birowosuto, M. D., Wee, A. T. S., Rusydi, A.
9 Novel Mechanistic Insights into Methane Activation over Fe and Cu Active Sites in Zeolites: A Comparative DFT Study Using Meta-GGA Functionals
The Journal of Physical Chemistry C, Volume 124, Issue 33, Page 18112
ISSN: 1932-7447
DOI: 10.1021/acs.jpcc.0c04991
Mahyuddin, M.H., Staykov, A., Saputro, A.G., Agusta, M.K., Dipojono, H.K., Yoshizawa, K.
8 Active Catalyst for Methane Hydroxylation by an Iridium-Oxo Complex
ACS Catalysis, Volume 10, Issue 15, Page 8254–8262
ISSN: 2155-5435
DOI: 10.1021/acscatal.0c01610
Ikeda, K., Mahyuddin, M.H., Shiota, Y., Yoshizawa, K.
7 PWDFT.jl: A Julia package for electronic structure calculation using density functional theory and plane wave basis
Computer Physics Communications, Volume 256, No. 107372
ISSN: 0010-4655
DOI: 10.1016/j.cpc.2020.107372
Fathurrahman, F., Agusta, M.K., Saputro, A.G., Dipojono, H.K. 
6 Dissociative Oxygen Reduction Reaction Mechanism on the Neighboring Active Sites of Boron-Doped Pyrolyzed Fe-N-C Catalyst
The Journal of Physical Chemistry C, Volume 124, Issue 21, Page 11383
ISSN: 1932-7447
DOI: 10.1021/acs.jpcc.0c00632
Saputro, A.G., Fajrial, A.K., Maulana, A.L., Fathurrahman, F., Agusta, M.K., Akbar, F.T., Dipojono, H.K. 
5 Effect of Surface Defects on the Interaction of Oxygen Molecule with ZnO(1010) Surface
New Journal of Chemistry, Volume 44, Issue 18, 6 April 2020, Page 7376
ISSN: 1369-9261
DOI: 10.1039/C9NJ06338B
Saputro, A.G., Akbar, F.T., Setyagar, N.P.P., Agusta, M.K., Pramudya, A.D., Dipojono, H.K. 
4 Room-Temperature Activation of Methane and Direct Formations of Acetic Acid and Methanol on Zn-ZSM-5 Zeolite: A Mechanistic DFT Study
(AWARD-Winning Paper)
Bulletin of the Chemical Society of Japan, Volume 93, Issue 3, 15 February 2020, Page 345
ISSN: 1348-0634
DOI: 10.1246/bcsj.20190282
Mahyuddin, M.H., Tanaka, S., Shiota, Y., Yoshizawa, K.
3 Computational Study on the Light-Induced Oxidation of Iridium-Aqua Complex to Iridium-Oxo Complex over WO3(001) Surface
Inorganic Chemistry, Volume 59, Issue 1, 12 January 2020, Page 415
ISSN: 0020-1669
DOI: 10.1021/acs.inorgchem.9b02704
Ikeda, K., Mahyuddin, M.H., Shiota, Y., Staykov, A., Matsumoto, T., Yoshizawa, K., Ogo, S.
2 Coadsorption of hydrazine (N2H4) and OH on NiZn surface: A DFT-based study
Surface Science, Volume 691, January 2020, Article number 121505.
ISSN: 0039-6028
DOI: 10.1016/j.susc.2019.121505
Agusta, M.K., Saputro, A.G., Ihsan, A.Z.,Krishna, R., Fathurrahman, F., Dipojono, H.K., Diño, W.A.
1 DFT+U study of H2O adsorption and dissociation on stoichiometric and nonstoichiometric CuO(1 1 1) surfaces
Journal of physics. Condensed matter: an Institute of Physics Journal. Volume 32, Issue 4, 23 January 2020, Page 045001.
ISSN: 1361648X
DOI: 10.1088/1361-648X/ab4b34
Ahmad, F., Agusta, M.K., Maezono, R., Dipojono, H.K.