--- /dev/null
+====================MD calculation start====================
+ acceleration/energy drift too large 33.4751872461861
+ 1.38691404383669 split increased to 2 itime 166636
+ itsplit 1
+ acceleration/energy drift too large 20.2890583963300
+ 1.18867876602111 split increased to 2 itime 182714
+ itsplit 1
+ acceleration/energy drift too large 20.6699218634773
+ 1.18574720208309 split increased to 2 itime 238523
+ itsplit 1
+ acceleration/energy drift too large 23.8278945229627
+ 0.923608750719812 split increased to 2 itime 272726
+ itsplit 1
+ acceleration/energy drift too large 35.4729437633830
+ 1.88112303096758 split increased to 2 itime 367586
+ itsplit 1
+ acceleration/energy drift too large 41.2306778634402
+ 1.56338130844387 split increased to 2 itime 439413
+ itsplit 1
+ acceleration/energy drift too large 20.4588124627796
+ 0.720944803924687 split increased to 2 itime 487024
+ itsplit 1
+ acceleration/energy drift too large 28.4695243734328
+ 2.05737326191522 split increased to 2 itime 487025
+ itsplit 1
+ acceleration/energy drift too large 21.8314781110461
+ 3.14623684545060 split increased to 2 itime 539618
+ itsplit 1
+ acceleration/energy drift too large 23.8953514154246
+ 0.723699824413302 split increased to 2 itime 539838
+ itsplit 1
+ acceleration/energy drift too large 22.0020599857867
+ 0.892869142543182 split increased to 2 itime 635110
+ itsplit 1
+ acceleration/energy drift too large 20.5331394431019
+ 1.31601847767160 split increased to 2 itime 678541
+ itsplit 1
+ acceleration/energy drift too large 22.9848227656450
+ 0.647540416171181 split increased to 2 itime 708066
+ itsplit 1
+ acceleration/energy drift too large 25.0162156562018
+ 1.04795930695230 split increased to 2 itime 709650
+ itsplit 1
+ acceleration/energy drift too large 44.3224791137547
+ 1.68588717052449 split increased to 2 itime 800155
+ itsplit 1
+ acceleration/energy drift too large 25.9586027154641
+ 1.14102074935945 split increased to 2 itime 812029
+ itsplit 1
+ acceleration/energy drift too large 33.2466826301064
+ 1.00876559858637 split increased to 2 itime 892115
+ itsplit 1
+ acceleration/energy drift too large 164.003664699874
+ 20.5145028875856 split increased to 2 itime 930145
+ itsplit 1
+
+
+=================================== Timing ===================================
+
+ MD calculations setup: 1.17188E-02
+ Energy & gradient evaluation: 3.49918E+02
+ Stochastic MD setup: 0.00000E+00
+ Stochastic MD step setup: 0.00000E+00
+
+
+=================================== Timing ===================================
+
+ MD calculations setup: 7.81250E-03
+ Energy & gradient evaluation: 3.50855E+02
+ Stochastic MD setup: 0.00000E+00
+ Stochastic MD step setup: 0.00000E+00
+ MD steps: 3.79402E+02
+
+
+============================ End of MD calculation ===========================
+ 7.81250E-03
+ Energy & gradient evaluation: 3.47789E+02
+ Stochastic MD setup: 0.00000E+00
+ Stochastic MD step setup: 0.00000E+00
+ MD steps: 3.76191E+02
+
+
+============================ End of MD calculation ===========================
+ 942496
+ itsplit 1
+
+
+=================================== Timing ===================================
+
+ MD calculations setup: 7.81250E-03
+ Energy & gradient evaluation: 3.55586E+02
+ Stochastic MD setup: 0.00000E+00
+ Stochastic MD step setup: 0.00000E+00
+ MD steps: 3.84367E+02
+
+
+============================ End of MD calculation ===========================
+ 1.17188E-02
+ Energy & gradient evaluation: 3.50984E+02
+ Stochastic MD setup: 0.00000E+00
+ Stochastic MD step setup: 0.00000E+00
+ MD steps: 3.79457E+02
+
+
+============================ End of MD calculation ===========================
+ 948974
+ itsplit 1
+
+
+=================================== Timing ===================================
+
+ MD calculations setup: 7.81250E-03
+ Energy & gradient evaluation: 3.50109E+02
+ Stochastic MD setup: 0.00000E+00
+ Stochastic MD step setup: 0.00000E+00
+ MD steps: 3.78668E+02
+
+
+============================ End of MD calculation ===========================
+ 976274
+ itsplit 1
+
+
+=================================== Timing ===================================
+
+ MD calculations setup: 1.17188E-02
+ Energy & gradient evaluation: 3.53207E+02
+ Stochastic MD setup: 0.00000E+00
+ Stochastic MD step setup: 0.00000E+00
+ MD steps: 3.82863E+02
+
+
+============================ End of MD calculation ===========================