[1]

Meng FS, Li Z, Ding HH, Hu JS, Wang WJ, et al. 2021. Study on the preparation and tribological properties of BN@C-OA nano-additive lubricants. Wear 474–475:203876

doi: 10.1016/j.wear.2021.203876
[2]

Song W, Li J, Zeng C, Ouyang C, Sun S, et al. 2023. Tribo-catalysis triggered the in-situ formation of amphiphilic molecules to reduce friction and wear. Tribology International 185:108541

doi: 10.1016/j.triboint.2023.108541
[3]

Ruan X, Wang X, Zhou R, Zhao Y, Bao L, et al. 2024. Dynamic chemisorption and tribochemistry of α-lipoic-acid-ester on ferrous surfaces. Tribology International 192:109291

doi: 10.1016/j.triboint.2024.109291
[4]

Jin Y, Duan H, Wei L, Cheng B, Chen S, et al. 2019. Comparison of the oxidation resistance of synthetic ester oils DOA and TDTM: experimental evaluation and theoretical calculation. Lubrication Science 31:252−61

doi: 10.1002/ls.1460
[5]

Sidh KN, Hirani H. 2025. Friction, wear, and corrosion resistance performance of carbon-based nanoparticles in aged lubricant. Tribology International 211:110869

doi: 10.1016/j.triboint.2025.110869
[6]

Campen S, Fong CWJ, Song W, Wong JSS. 2022. Thermal degradation of n-hexadecane base oil and its impact on boundary friction and surface adsorption. Tribology International 170:107492

doi: 10.1016/j.triboint.2022.107492
[7]

Gan Z, Yao T, Zhang M, Hu J, Liao X, et al. 2020. Effect of temperature on the composition of a synthetic hydrocarbon aviation lubricating oil. Materials 13(7):1606

doi: 10.3390/ma13071606
[8]

Farfan-Cabrera LI, Gallardo-Hernández EA, Gómez-Guarneros M, Pérez-González J, Godínez-Salcedo JG. 2020. Alteration of lubricity of Jatropha oil used as bio-lubricant for engines due to thermal ageing. Renewable Energy 149:1197−204

doi: 10.1016/j.renene.2019.10.116
[9]

Mascolo G, Rausa R, Mininni G, Tinucci L. 2004. The gas phase decomposition of synthetic lubricants under pyrolytic conditions. Journal of Analytical and Applied Pyrolysis 71:165−78

doi: 10.1016/S0165-2370(03)00084-6
[10]

Vrandečić NS, Erceg M, Jakić M, Klarić I. 2010. Kinetic analysis of thermal degradation of poly(ethylene glycol) and poly(ethylene oxide)s of different molecular weight. Thermochimica Acta 498:71−80

doi: 10.1016/j.tca.2009.10.005
[11]

Kashi S, De Souza M, Creighton C, Al-Assafi S, Varley R. 2023. Degradation of polyalkylene glycol: application of FTIR, HPLC, and TGA in investigating PAG oil thermal stability and antioxidant reaction kinetics. Industrial & Engineering Chemistry Research 62:19638−48

doi: 10.1021/acs.iecr.3c02847
[12]

Chen T, Yang S, Ma J, Gao H, Xu X, et al. 2024. Real-time oxidation and coking behavior of ester aviation lubricating oil in aircraft engines. Tribology International 192:109240

doi: 10.1016/j.triboint.2023.109240
[13]

Yu H, Zheng Z, Chen H, Qiao D, Feng D, et al. 2022. An investigation of tribochemical reaction kinetics from the perspective of tribo-oxidation. Tribology International 165:107289

doi: 10.1016/j.triboint.2021.107289
[14]

Fukushima Y, Tada I, Nanao H, Mori S, Aoki S. 2016. Combined effect of phosphate ester and OBCS on tribochemical decomposition of hydrocarbon oil on nascent steel surfaces. Tribology Letters 63:3

doi: 10.1007/s11249-016-0687-6
[15]

Urness KN, Gough RV, Widegren JA, Bruno TJ. 2016. Thermal decomposition kinetics of polyol ester lubricants. Energy & Fuels 30(12):10161−70

doi: 10.1021/acs.energyfuels.6b01863
[16]

Yao T, Zhang N, Zhang M, She X, Liao X, et al. 2021. Effect of iron and copper on the thermal oxidation stability of synthetic hydrocarbon aviation lubricating oil. Catalysis Communications 161:106363

doi: 10.1016/j.catcom.2021.106363
[17]

Singh A, Gandra RT, Schneider EW, Biswas SK. 2011. Lubricant degradation and related wear of a steel pin in lubricated sliding against a steel disc. ACS Applied Materials & Interfaces 3:2512−21

doi: 10.1021/am200375a
[18]

John PJ, Cutler JN, Sanders JH. 2001. Tribological behavior of a multialkylated cyclopentane oil under ultrahigh vacuum conditions. Tribology Letters 9:167−73

doi: 10.1023/A:1018808921623
[19]

Ren D, Gellman AJ. 2001. Reaction mechanisms in organophosphate vapor phase lubrication of metal surfaces. Tribology International 34:353−65

doi: 10.1016/S0301-679X(01)00025-1
[20]

Diaby M, Sablier M, Le Negrate A, El Fassi M, Bocquet J. 2009. Understanding carbonaceous deposit formation resulting from engine oil degradation. Carbon 47:355−66

doi: 10.1016/j.carbon.2008.10.014
[21]

El Naga HHA, Salem AEM. 1984. Effect of worn metals on the oxidation of lubricating oils. Wear 96:267−83

doi: 10.1016/0043-1648(84)90041-3
[22]

Aida F, Tagawa K. 2024. Silyl ether-modified polyalkylene glycols with high viscosity index. Chemistry Letters 53(12):upae231

doi: 10.1093/chemle/upae231
[23]

Mohd Zaki S, Abd Aziz MS, Ismail MF, Abdollah MF, Ramadhan AI, et al. 2025. Critical properties of refrigeration lubricants in modern refrigeration system: a review. Journal of Advanced Research in Fluid Mechanics and Thermal Sciences 131(1):244−62

doi: 10.37934/arfmts.131.1.244262
[24]

Tau O, Lovergine N, Prete P. 2023. Adsorption and decomposition steps on Cu(111) of liquid aromatic hydrocarbon precursors for low-temperature CVD of graphene: a DFT study. Carbon 206:142−49

doi: 10.1016/j.carbon.2023.02.011
[25]

Tau O, Lovergine N, Prete P. 2024. Molecular decomposition reactions and early nucleation steps in CVD growth of graphene on Cu and Si substrates using toluene. Proceedings Volume 13114, Low-Dimensional Materials and Devices 2024, San Diego, California, 2024. Bellingham: SPIE. pp. 1311409 doi: 10.1117/12.3029561
[26]

Kresse G, Furthmüller J. 1996. Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set. Computational Materials Science 6:15−50

doi: 10.1016/0927-0256(96)00008-0
[27]

Kresse G, Furthmüller J. 1996. Efficient iterative schemes for ab initio total-energy calculations using a plane-wave basis set. Physical Review B: Condensed Matter and Materials Physics 54:11169−86

doi: 10.1103/PhysRevB.54.11169
[28]

Blöchl PE. 1994. Projector augmented-wave method. Physical Review B 50:17953−79

doi: 10.1103/PhysRevB.50.17953
[29]

Perdew J, Burke K, Ernzerhof M. 1996. Generalized gradient approximation made simple. Physical Review Letters 77:3865−68

doi: 10.1103/PhysRevLett.78.1396
[30]

Makov G, Payne MC. 1995. Periodic boundary conditions in ab initio calculations. Physical Review B 51:4014−22

doi: 10.1103/PhysRevB.51.4014
[31]

Grimme S, Antony J, Ehrlich S, Krieg H. 2010. A consistent and accurate ab initio parametrization of density functional dispersion correction (DFT-D) for the 94 elements H-Pu. The Journal of Chemical Physics 132:154104

doi: 10.1063/1.3382344
[32]

Henkelman G, Uberuaga BP, Jónsson H. 2000. A climbing image nudged elastic band method for finding saddle points and minimum energy paths. The Journal of Chemical Physics 113:9901−4

doi: 10.1063/1.1329672
[33]

Henkelman G, Jónsson H. 2000. Improved tangent estimate in the nudged elastic band method for finding minimum energy paths and saddle points. The Journal of Physical Chemistry C 113:9978−85

doi: 10.1063/1.1323224
[34]

Heyden A, Bell AT, Keil FJ. 2005. Efficient methods for finding transition states in chemical reactions: comparison of improved dimer method and partitioned rational function optimization method. The Journal of Chemical Physics 123:224101

doi: 10.1063/1.2104507
[35]

Jo DY, Ham HC, Lee KY. 2020. Facet-dependent electrocatalysis in the HCOOH synthesis from CO2 reduction on Cu catalyst: a density functional theory study. Applied Surface Science 527:146857

doi: 10.1016/j.apsusc.2020.146857
[36]

Frisch MJ, Trucks GW, Schlegel HB, Scuseria GE, Robb MA, et al. 2019. Gaussian 16, Revision C. 01. Gaussian, Inc., Wallingford CT
[37]

Ishikawa A, Neurock M, Iglesia E. 2007. Structural requirements and reaction pathways in dimethyl ether combustion catalyzed by supported Pt clusters. Journal of the American Chemical Society 129:13201−12

doi: 10.1021/ja073712z
[38]

Zhang X, Ruan S, Yin J, Bin F, Lang H, et al. 2023. DFT studies of the adsorption and decomposition of dimethyl ether on copper surface. Applied Surface Science 627:157310

doi: 10.1016/j.apsusc.2023.157310
[39]

Chiu CC, Genest A, Borgna A, Rösch N. 2014. Hydrodeoxygenation of guaiacol over Ru(0001): a DFT study. ACS Catalysis 4:4178−88

doi: 10.1021/cs500911j
[40]

Blanksby SJ, Ellison GB. 2003. Bond dissociation energies of organic molecules. Accounts of Chemical Research 36:255−63

doi: 10.1021/ar020230d