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2022
X. Wang, R.R. De Vecchis, C. Li, H. Zhang, X. Hu, S. Sridar, Y. Wang, W. Chen, and W. Xiong, "Design metastability in high-entropy alloys by tailoring unstable fault energies", Science Advances, 8 (36), abo7333 (2022)
G. Yan, G. Kim, R. Yuan, E. Hoenig, F. Shi, W. Chen, Y. Han, Q. Chen, J.-M. Zuo, W. Chen, and C. Liu, "The role of solid solutions in iron phosphate-based electrodes for selective electrochemical lithium extraction", Nature Communications, 13, 4579 (2022)
J. Zhang, C. Cai, G. Kim, Y. Wang, and W. Chen, "Composition design of high-entropy alloys with deep sets learning", npj Computational Materials, 8, 89 (2022)
J. Wei, L. Shaw, and W. Chen, "First-principles comparative study of Cr migration in O3 and O/P hybrid-phased NaCrO2", Physical Review Materials, 6, 095403 (2022)
X. Wang, F. Jahanbazi, J. Wei, C.U. Segre, W. Chen, and Y. Mao, "Charge transfer-triggered Bi3+ near-infrared emission in Y2Ti2O7 for dual-mode temperature sensing", ACS Applied Materials & Interfaces, 14 (32), 36834-36844 (2022)
R. Feng, G. Kim, D. Yu, Y. Chen, W. Chen, P.K. Liaw, and K. An, "Elastic behavior of binary and ternary refractory multi-principal-element alloys", Materials & Design, 219, 110820 (2022)
X. Kang, L. Kang, W. Chen, and X. Deng, "A generative approach to modeling data with quantitative and qualitative responses", Journal of Multivariate Analysis, 190, 104952 (2022)
G. Yan, G. Kim, R. Yuan, E. Hoenig, F. Shi, W. Chen, Y. Han, Q. Chen, J.-M. Zuo, W. Chen, and C. Liu, "The role of solid solutions in iron phosphate-based electrodes for selective electrochemical lithium extraction", Nature Communications, 13, 4579 (2022)
J. Zhang, C. Cai, G. Kim, Y. Wang, and W. Chen, "Composition design of high-entropy alloys with deep sets learning", npj Computational Materials, 8, 89 (2022)
J. Wei, L. Shaw, and W. Chen, "First-principles comparative study of Cr migration in O3 and O/P hybrid-phased NaCrO2", Physical Review Materials, 6, 095403 (2022)
X. Wang, F. Jahanbazi, J. Wei, C.U. Segre, W. Chen, and Y. Mao, "Charge transfer-triggered Bi3+ near-infrared emission in Y2Ti2O7 for dual-mode temperature sensing", ACS Applied Materials & Interfaces, 14 (32), 36834-36844 (2022)
R. Feng, G. Kim, D. Yu, Y. Chen, W. Chen, P.K. Liaw, and K. An, "Elastic behavior of binary and ternary refractory multi-principal-element alloys", Materials & Design, 219, 110820 (2022)
X. Kang, L. Kang, W. Chen, and X. Deng, "A generative approach to modeling data with quantitative and qualitative responses", Journal of Multivariate Analysis, 190, 104952 (2022)
2021 |
G. Kim, Q. Gu, P. Nash, and W. Chen, "Site preferences and ordering in Nb(Al1-xMx)2 (M = Ni or Cu) ternary Laves phases", Acta Materialia, 208, 116733 (2021)
C. Hu, E. Song, M. Wang, W. Chen, F. Huang, Z. Feng, J. Liu, and J. Wang, "Partial-single-atom, partial-nanoparticle composites enhance water dissociation for hydrogen evolution", Advanced Science, 8 (2), 2001881 (2021)
2020
C. Lee, Y. Chou, G. Kim, M.C. Gao, K. An, J. Brechtl, C. Zhang, W. Chen, J.D. Poplawsky, G. Song, Y. Ren, Y.-C. Chou, and P.K. Liaw, "Lattice-distortion-enhanced yield strength in a refractory high-entropy alloy", Advanced Materials, 32 (49), 2004029 (2020)
C. Hu, J. Hong, J. Huang, W. Chen, C.U. Segre, K. Suenaga, W. Zhao, F. Huang, and J. Wang, "Surface decoration accelerates hydrogen evolution kinetics of perovskite oxide in alkaline solution", Energy & Environmental Science, 13, 4249-4257 (2020)
Y. Zhou, E. Song, W. Chen, C.U. Segre, J. Zhou, Y.-C. Lin, C. Zhu, R. Ma, P. Liu, S. Chu, T. Thomas, M. Yang, Q. Liu, K. Suenaga, Z. Liu, J. Liu, and J. Wang, "Dual-metal interbonding as the chemical facilitator for the single-atom dispersions", Advanced Materials, 32 (46), 2003484 (2020)
C. Lee, G. Kim, Y. Chou, B.L. Musico, M.C. Gao, K. An, G. Song, Y-C. Chou, V. Keppens, W. Chen, and P.K. Liaw, "Temperature dependence of elastic and plastic deformation behavior of a ductile refractory high-entropy alloy", Science Advances, 6 (37), eaaz4748 (2020)
Q. Ju, R. Ma, Y. Hu, B. Guo, Q. Liu, T. Thomas, T. Zhang, M. Yang, W. Chen, and J. Wang, "Highly localized C-N2 sites for efficient oxygen reduction", ACS Catalysis, 10 (16), 9366-9375 (2020)
J. Wei, L.L. Shaw, and W. Chen, "First-principles prediction of Na diffusivity in doped NaCrO2 layered cathode materials with van der Waals interactions", Journal of Physical Chemistry C, 124, 12239-12248 (2020)
M. Esmaeilirad, A. Kondori, B. Song, A.R. Belmonte, J. Wei, K. Kucuk, S.M. Khanvilkar, E. Efimoff, W. Chen, C.U. Segre, R. Shahbazian-Yassar, and M. Asadi, "Oxygen functionalized copper nanoparticles for solar-driven conversion of carbon dioxide to methane", ACS Nano, 14, 2099-2108 (2020)
2019
G. Kim, H. Diao, C. Lee, A.T. Samaei, T. Phan, M. de Jong, K. An, D. Ma, P.K. Liaw, and W. Chen, "First-principles and machine learning predictions of elasticity in severely lattice-distorted high-entropy alloys with experimental validation", Acta Materialia, 181, 124-138 (2019)
L. Li, G. Kim, W. Chen, and S. Tin, "Effect of phosphorus on the phase stability of a high refractory content powder-processed Ni-base superalloy", Metallurgical and Materials Transaction A, 50, 11, 5459-5475 (2019)
A. Kondori, M. Esmaeilirad, A. Baskin, B. Song, J. Wei, W. Chen, C.U. Segre, R. Shahbazian-Yassar, D. Prendergast, and M. Asadi, "Identifying catalytic active sites of trimolybdenum phosphide (Mo3P) for electrochemical hydrogen evolution", Advanced Energy Materials, 1900516 (2019)
M. Luo, A.L. Ortiz, F. Guo, Z. Shi, L. Li, Y. Ren, X. Zhang, Z. Chen, L.L. Shaw, and W. Chen, "Mechanical activation enhanced solid-state synthesis of NaCrO2 cathode material", Materialia, 5, 100172 (2019) [PDF]
S. Antonov, W. Chen, S. Lu, D. Isheim, D.N. Siedman, Q. Feng, E. Sun, and S. Tin, "The effect of phosphorus on the formation of grain boundary laves phase in high-refractory content Ni-based superalloys", Scripta Materialia, 161, 44-48 (2019) [PDF]
S.Y. Chen, Y. Tong, K.K. Tseng, J.W. Yeh, J.D. Poplawsky, J.C. Wen, M.C. Gao, G. Kim, W. Chen, Y. Ren, R. Feng, W.D. Li, and P.K. Liaw, "Phase transformations of HfNbTaTiZr high-entropy alloy at intermediate temperatures", Scripta Materialia, 158, 50-56 (2019) [PDF]
L. Li, G. Kim, W. Chen, and S. Tin, "Effect of phosphorus on the phase stability of a high refractory content powder-processed Ni-base superalloy", Metallurgical and Materials Transaction A, 50, 11, 5459-5475 (2019)
A. Kondori, M. Esmaeilirad, A. Baskin, B. Song, J. Wei, W. Chen, C.U. Segre, R. Shahbazian-Yassar, D. Prendergast, and M. Asadi, "Identifying catalytic active sites of trimolybdenum phosphide (Mo3P) for electrochemical hydrogen evolution", Advanced Energy Materials, 1900516 (2019)
M. Luo, A.L. Ortiz, F. Guo, Z. Shi, L. Li, Y. Ren, X. Zhang, Z. Chen, L.L. Shaw, and W. Chen, "Mechanical activation enhanced solid-state synthesis of NaCrO2 cathode material", Materialia, 5, 100172 (2019) [PDF]
S. Antonov, W. Chen, S. Lu, D. Isheim, D.N. Siedman, Q. Feng, E. Sun, and S. Tin, "The effect of phosphorus on the formation of grain boundary laves phase in high-refractory content Ni-based superalloys", Scripta Materialia, 161, 44-48 (2019) [PDF]
S.Y. Chen, Y. Tong, K.K. Tseng, J.W. Yeh, J.D. Poplawsky, J.C. Wen, M.C. Gao, G. Kim, W. Chen, Y. Ren, R. Feng, W.D. Li, and P.K. Liaw, "Phase transformations of HfNbTaTiZr high-entropy alloy at intermediate temperatures", Scripta Materialia, 158, 50-56 (2019) [PDF]
2018
C. Lee, G. Song, M.C. Gao, R. Feng, P. Chen, J. Brechtl, Y. Chen, K. An, W. Guo, J.D. Poplawsky, S. Li, A.T. Samaei, W. Chen, A. Hu, H. Choo, P.K. Liaw, "Lattice distortion in a strong and ductile refractory high-entropy alloy", Acta Materialia, 160, 158-172 (2018) [PDF]
S. Antonov, W. Chen, J. Huo, Q. Feng, D. Isheim, D.N. Seidman, E. Sun, and S. Tin, "MC carbide characterization in high refractory content powder-processed Ni-based superalloys", Metallurgical and Materials Transactions A, 49, 2340-2351 (2018) [PDF]
W. Chen, "High-throughput computing for accelerated materials discovery", In: Shin D., Saal J. (eds) Computation Materials System Design, 169-191, Springer (2018)
S. Antonov, W. Chen, J. Huo, Q. Feng, D. Isheim, D.N. Seidman, E. Sun, and S. Tin, "MC carbide characterization in high refractory content powder-processed Ni-based superalloys", Metallurgical and Materials Transactions A, 49, 2340-2351 (2018) [PDF]
W. Chen, "High-throughput computing for accelerated materials discovery", In: Shin D., Saal J. (eds) Computation Materials System Design, 169-191, Springer (2018)
2017
G. Kim, S.V. Meschel, P. Nash, and W. Chen, "Experimental formation enthalpies for intermetallic phases and other inorganic compounds", Scientific Data, 4, 170162 (2017) [PDF]
F. Ricci, W. Chen, U. Aydemir, G.J. Snyder, G. Rignanese, A. Jain, and G. Hautier, "An ab initio electronic transport database for inorganic materials", Scientific Data, 4, 170085 (2017) [PDF]
Q. Yan, J. Yu, S.K. Suram, L. Zhou, A. Shinde, P.F. Newhouse, W. Chen, G. Li, K.A. Persson, J.M. Gregoire, J.B. Neaton, "Solar fuels photoanode materials discovery by integrating high-throughput theory and experiment", Proceedings of the National Academy of Sciences, 114, 3040-3043 (2017) [PDF]
T. Yi, W. Chen, L. Cheng, R. Bayliss, F. Lin, M. Plews, D. Nordlund, M. Doeff, K. Persson and J. Cabana, "Investigating the intercalation chemistry of alkali ions in fluoride perovskites", Chemistry of Materials, 29, 1561-1568 (2017) [PDF]
I. Petousis, D. Mrdjenovich, E. Ballouz, M. Liu, D. Winston, W. Chen, T. Graf, T.D. Schladt, K.A. Persson and F.B. Prinz, "High-throughput screening of inorganic compounds for the discovery of novel dielectric and optical materials", Scientific Data, 4, 160134 (2017) [PDF]
F. Ricci, W. Chen, U. Aydemir, G.J. Snyder, G. Rignanese, A. Jain, and G. Hautier, "An ab initio electronic transport database for inorganic materials", Scientific Data, 4, 170085 (2017) [PDF]
Q. Yan, J. Yu, S.K. Suram, L. Zhou, A. Shinde, P.F. Newhouse, W. Chen, G. Li, K.A. Persson, J.M. Gregoire, J.B. Neaton, "Solar fuels photoanode materials discovery by integrating high-throughput theory and experiment", Proceedings of the National Academy of Sciences, 114, 3040-3043 (2017) [PDF]
T. Yi, W. Chen, L. Cheng, R. Bayliss, F. Lin, M. Plews, D. Nordlund, M. Doeff, K. Persson and J. Cabana, "Investigating the intercalation chemistry of alkali ions in fluoride perovskites", Chemistry of Materials, 29, 1561-1568 (2017) [PDF]
I. Petousis, D. Mrdjenovich, E. Ballouz, M. Liu, D. Winston, W. Chen, T. Graf, T.D. Schladt, K.A. Persson and F.B. Prinz, "High-throughput screening of inorganic compounds for the discovery of novel dielectric and optical materials", Scientific Data, 4, 160134 (2017) [PDF]
2016
B. Medasani, A. Gamst, H. Ding, W. Chen, K.A. Persson, M. Asta, A. Canning and M. Haranczyk, "Predicting defect behavior in B2 intermetallics by merging ab initio modeling and machine learning", npj Computational Materials, 2, 1 (2016) [PDF]
✐ Machine learning method accurately predicts metallic defects: Berkeley Lab research could accelerate development of new metallic materials for the aerospace industry, Berkeley Lab News
M. de Jong, W. Chen, R. Notestine, K. Persson, G. Ceder, A. Jain, M. Asta and A. Gamst, "A statistical learning framework for materials science: Application to elastic moduli of k-nary inorganic polycrystalline compounds", Scientific Reports, 6, 34256 (2016) [PDF]
W. Chen, J.H. Pohls, G. Hautier, D. Broberg, S. Bajaj, U. Aydemir, Z.M. Gibbs, H. Zhu, M. Asta, G.J. Snyder, B. Meredig, M.A. White, K. Persson and A. Jain," Understanding thermoelectric properties from high-throughput calculations: Trends, insights, and comparisons with experiment", Journal of Materials Chemistry C, 4, 4414-4426 (2016) [PDF]
I. Petousis, W. Chen, G. Hautier, T. Graf, T.D. Schladt, K.A. Persson and F.B Prinz, "Benchmarking density functional perturbation theory to enable high-throughput screening of materials for dielectric constant and refractive index", Physical Review B, 93, 115151 (2016) [PDF]
U. Aydemir, J-H. Pöhls, H. Zhu, G. Hautier, S. Bajaj, Z.M. Gibbs, W. Chen, G. Li, S. Ohno, D. Broberg, S.D. Kang, M.A. White, M. Asta, G. Ceder, K. Persson, A. Jain and G.J. Snyder, "YCuTe2: A member of a new class of thermoelectric materials with CuTe4-based layered structure", Journal of Materials Chemistry A, 4, 2461-2472 (2016) [PDF]
A. Yan, W. Chen, C. Ophus, J. Ciston, Y. Lin, K. Persson, and A. Zettl, "Identifying different stacking sequences in few-layer CVD-grown MoS2 by low-energy atomic-resolution STEM", Physical Review B: Rapid Communications, 93, 041420(R) (2016) [PDF]
M. Yin, P. Nash, W. Chen, and S. Chen, "Standard enthalpies of formation of selected Ni2YZ Heusler compounds", Journal of Alloys and Compounds, 660, 258-265 (2016) [PDF]
✐ Machine learning method accurately predicts metallic defects: Berkeley Lab research could accelerate development of new metallic materials for the aerospace industry, Berkeley Lab News
M. de Jong, W. Chen, R. Notestine, K. Persson, G. Ceder, A. Jain, M. Asta and A. Gamst, "A statistical learning framework for materials science: Application to elastic moduli of k-nary inorganic polycrystalline compounds", Scientific Reports, 6, 34256 (2016) [PDF]
W. Chen, J.H. Pohls, G. Hautier, D. Broberg, S. Bajaj, U. Aydemir, Z.M. Gibbs, H. Zhu, M. Asta, G.J. Snyder, B. Meredig, M.A. White, K. Persson and A. Jain," Understanding thermoelectric properties from high-throughput calculations: Trends, insights, and comparisons with experiment", Journal of Materials Chemistry C, 4, 4414-4426 (2016) [PDF]
I. Petousis, W. Chen, G. Hautier, T. Graf, T.D. Schladt, K.A. Persson and F.B Prinz, "Benchmarking density functional perturbation theory to enable high-throughput screening of materials for dielectric constant and refractive index", Physical Review B, 93, 115151 (2016) [PDF]
U. Aydemir, J-H. Pöhls, H. Zhu, G. Hautier, S. Bajaj, Z.M. Gibbs, W. Chen, G. Li, S. Ohno, D. Broberg, S.D. Kang, M.A. White, M. Asta, G. Ceder, K. Persson, A. Jain and G.J. Snyder, "YCuTe2: A member of a new class of thermoelectric materials with CuTe4-based layered structure", Journal of Materials Chemistry A, 4, 2461-2472 (2016) [PDF]
A. Yan, W. Chen, C. Ophus, J. Ciston, Y. Lin, K. Persson, and A. Zettl, "Identifying different stacking sequences in few-layer CVD-grown MoS2 by low-energy atomic-resolution STEM", Physical Review B: Rapid Communications, 93, 041420(R) (2016) [PDF]
M. Yin, P. Nash, W. Chen, and S. Chen, "Standard enthalpies of formation of selected Ni2YZ Heusler compounds", Journal of Alloys and Compounds, 660, 258-265 (2016) [PDF]
2015
M. de Jong, W. Chen, H. Geerlings, M. Asta, and K.A. Persson, "A database to enable discovery and design of piezoelectric materials", Scientific Data, 2, 150053 (2015) [PDF][Dryad Digital Repository][Materials Project] (Front page feature article)
✐ Computing a textbook of crystal physics: Berkeley lab scientists publish world's largest database of piezoelectric properties, Berkeley Lab News Center
M. de Jong, W. Chen, T. Angsten, A. Jain, R. Notestine, A. Gamst, M. Sluiter, C.K. Ande, S. van der Zwaag, J.J. Plata, C. Toher, S. Curtarolo, G. Ceder, K.A. Persson, and M. Asta, "Charting the complete elastic properties of inorganic crystalline compounds", Scientific Data, 2, 150009 (2015) [PDF][Dryad Digital Repository][Materials Project]
✐ Accelerating materials discovery with world's largest database of elastic properties: Berkeley lab scientists increase by almost ten-fold the data previously available, Berkeley Lab News Center
✐ Google-like database of materials properties aims to accelerate innovation, Scientific Computing
✐ DOE Lab Opens Access to New Materials Database, AIChE ChEnected
W. Sun, S. Jayaraman, W. Chen, G. Ceder, and K.A. Persson, "Nucleation of metastable aragonite CaCO3 in seawater", Proceedings of the National Academy of Sciences, 112 (11), 3199-3204 (2015) [PDF]
✐ Mystery solved: Why seashells' mineral forms differently in seawater. Century-old riddle about aragonite formation is unraveled by scientists atomic simulation, MIT News Office
H. Zhu, G. Hautier, U. Aydemir, Z.M. Gibbs, G. Li, S. Bajaj, J.H. Pöhls, D. Broberg, W. Chen, A. Jain, M.A. White, M. Asta, G.J. Snyder, K. Persson, and G. Ceder, "Computational and experimental investigation of TmAgTe2 and XYZ2 compounds, a new group of thermoelectric materials identified by first-principles high-throughput screening", Journal of Materials Chemistry C, 3, 10554-10565 (2015) [PDF]
L. Cheng, W. Chen, M. Kunz, K.A. Persson, N. Tamura, G. Chen, and M. Doeff, "Effect of surface microstructure on electrochemical performance of garnet solid electrolytes", ACS Applied Materials & Interfaces, 7 (3), 2073-2081 (2015) [PDF]
J. Yu, Q. Yan, W. Chen, A. Jain, J.B. Neaton, and K.A. Persson, "First-principles study of electronic structure and photocatalytic properties of MnNiO3 as an alkaline oxygen-evolution photocatalyst", Chemical Communications, 51, 2867-2870 (2015) [PDF]
A. Jain, S.P. Ong, W. Chen, B. Medasani, X. Qu, M. Kocher, M. Brafman, G. Petretto, G.M. Rignanese, G. Hautier, D. Gunter, and K. Persson, "Fireworks: a dynamic workflow system designed for high-throughput applications", Concurrency and Computation: Practice and Experience, 27 (17) 5037-5059 (2015) [PDF][GitHub]
L. Cheng, C.H. Wu, A. Jarry, W. Chen, Y. Ye, J. Zhu, R. Kostecki, K. Persson, J. Guo, M. Salmeron, G. Chen, and M. Doeff, "Interrelationships among grain size, surface composition, air stability, and interfacial resistance of Al-Substituted Li7La3Zr2O12 solid electrolytes", ACS Applied Materials & Interfaces, 7 (32), 17649-17655 (2015) [PDF]
H. Ding, B. Medasani, W. Chen, K.A. Persson, M. Haranczyk, and M. Asta, "PyDII: A python framework for computing equilibrium intrinsic point defect concentrations and extrinsic solute site preferences in intermetallic compounds", Computer Physics Communications, 193, 118-123 (2015) [PDF][GitHub][CPC Program Library]
J. Yan, L. Desborough, and W. Chen, "Continuous Glucose Monitoring (CGM) Data Mining for Sensor Glucose Prediction: A Machine Learning Perspective", Diabetes, 64, A243 (2015)
2014
W. Chen, W.F. Schneider, and C. Wolverton, "Trends in atomic adsorption on Pt3M (111) transition metal bimetallic surface overlayers", Journal of Physical Chemistry C, 118 (16), 8342-8349, (2014) [PDF]
L. Cheng, E.J. Crumlin, W. Chen, R. Qiao, H. Hou, S.F. Lux, V. Zorba, R. Russo, R. Kostecki, Z. Liu, K. Persson, W. Yang, J. Cabana, T. Richardson, G. Chen, and M. Doeff, "The origin of high electrolyte-electrode interfacial resistances in lithium cells containing garnet type solid electrolytes", Physical Chemistry Chemical Physics, 16, 18294-18300 (2014) [PDF]
R. Qiao, I.T. Lucas, A. Karim, J. Syzdek, X. Liu, W. Chen, K. Persson, R. Kostecki, and W. Yang, "Distinct solid-electrolyte-interphases on Sn (100) and (001) electrodes studies by soft X-ray spectroscopy", Advanced Materials Interfaces, 1 (3), 1300115 (2014) [PDF]
L. Cheng, E.J. Crumlin, W. Chen, R. Qiao, H. Hou, S.F. Lux, V. Zorba, R. Russo, R. Kostecki, Z. Liu, K. Persson, W. Yang, J. Cabana, T. Richardson, G. Chen, and M. Doeff, "The origin of high electrolyte-electrode interfacial resistances in lithium cells containing garnet type solid electrolytes", Physical Chemistry Chemical Physics, 16, 18294-18300 (2014) [PDF]
R. Qiao, I.T. Lucas, A. Karim, J. Syzdek, X. Liu, W. Chen, K. Persson, R. Kostecki, and W. Yang, "Distinct solid-electrolyte-interphases on Sn (100) and (001) electrodes studies by soft X-ray spectroscopy", Advanced Materials Interfaces, 1 (3), 1300115 (2014) [PDF]
2013
A. Jain, S.P. Ong, G. Hautier, W. Chen, W.D. Richards, S. Dacek, S. Cholia, D. Gunter, D. Skinner, G. Ceder, and K.A. Persson, "The Materials Project: A materials genome approach to accelerating materials innovation", APL Materials, 1, 011002 (2013) [PDF][Materials Project]
2012
W. Chen, P. Dalach, W.F. Schneider, and C. Wolverton, "Interplay between subsurface ordering, surface segregation and adsorption of ordered Pt-Ti(111) subsurface structures", Langmuir, 28 (10), 4683-4693 (2012) [PDF]
D.J. Schmidt, W. Chen, C. Wolverton, and W. F. Schneider, "Performance of cluster expansions of coverage-dependent adsorption of atomic oxygen on Pt(111)", Journal of Chemical Theory and Computation, 8 (1), 264-273 (2012) [PDF]
D.J. Schmidt, W. Chen, C. Wolverton, and W. F. Schneider, "Performance of cluster expansions of coverage-dependent adsorption of atomic oxygen on Pt(111)", Journal of Chemical Theory and Computation, 8 (1), 264-273 (2012) [PDF]
2011
W. Chen, D. Schmidt, W.F. Schneider, and C. Wolverton, "First-principles cluster expansion study of missing-row reconstructions of fcc (110) surfaces", Physical Review B, 83 (7), 075415 (2011) [PDF]
W. Chen, D. Schmidt, W.F. Schneider, and C. Wolverton, "Ordering and oxygen adsorption in Au-Pt/Pt(111) surface alloys", Journal of Physical Chemistry C, 115 (36), 17915-17924 (2011) [PDF]
Z. Mao, W. Chen, D.N. Seidman, and C. Wolverton, "First-principles study of the nucleation and stability of ordered precipitates in ternary Al–Sc–Li alloys", Acta Materialia, 59 (8), 3012-3023 (2011) [PDF]
W. Chen, D. Schmidt, W.F. Schneider, and C. Wolverton, "Ordering and oxygen adsorption in Au-Pt/Pt(111) surface alloys", Journal of Physical Chemistry C, 115 (36), 17915-17924 (2011) [PDF]
Z. Mao, W. Chen, D.N. Seidman, and C. Wolverton, "First-principles study of the nucleation and stability of ordered precipitates in ternary Al–Sc–Li alloys", Acta Materialia, 59 (8), 3012-3023 (2011) [PDF]
2008
W. Chen, Q. Liu, Q. Liu, L. Zhu, and L. Wang, "A combinatorial study of the corrosion and mechanical properties of Zn–Al material library fabricated by ion beam sputtering", Journal of Alloys and Compounds, 459(1-2), 261-266 (2008) [PDF]
2006
W. Chen and J. Sun, "The electronic structure and mechanical properties of MgCu2 Laves phase compound", Physica B: Condensed Matter, 382 (1-2), 279-284 (2006) [PDF]
