 |
 |
 |
 |
 |
 |
||
 |
 |
 |
 |
 |
| 5 | 1/1 | 返回列表 |
| 查看: 1502 | 回復(fù): 4 | ||
nanost木蟲 (知名作家)
Dr.
|
[求助]
VASP安裝求助 已有1人參與
|
|
本人筆記本安裝vasp出現(xiàn)以下問題，采用ifort2015編譯器 $ make ./preprocess <base.F | /usr/bin/cpp -P -C -traditional >base.f90 -DHOST=\"LinuxIFC\" -Dkind8 -DCACHE_SIZE=12000 -DPGF90 -Davoidalloc -DNGXhalf ifort -FR -lowercase -assume byterecl -O3 -c base.f90 ifort: command line remark #10148: option '-lowercase' not supported base.f90(1): error #5082: Syntax error, found '/' when expecting one of: <LABEL> <END-OF-STATEMENT> ; BLOCK PROGRAM BLOCKDATA MODULE INTEGER REAL COMPLEX ... /* Copyright (C) 1991-2014 Free Software Foundation, Inc. ^ base.f90(16): error #5145: Invalid blank/tab <http://www.gnu.org/licenses/>. */ ----------------------------------^ base.f90(20): error #5145: Invalid blank/tab include it implicitly at the start of every compilation. It must -----------------------------------------------------------^ base.f90(27): error #5120: Unterminated character constant /* glibc's intent is to support the IEC 559 math functionality, real --------^ base.f90(27): error #5144: Invalid character_kind_parameter. No underscore /* glibc's intent is to support the IEC 559 math functionality, real --------------------------------------------------------------------^ base.f90(28): error #5145: Invalid blank/tab and complex. If the GCC (4.9 and later) predefined macros ---------------^ base.f90(30): error #5277: Syntax error, found ',' following statement keyword whether the overall intent is to support these features; otherwise, ----------------------------------------------------------------------^ base.f90(32): error #5145: Invalid blank/tab define these macros by default. */ ----------------------------------^ base.f90(36): error #5143: Missing mandatory separating blank /* wchar_t uses ISO/IEC 10646 (2nd ed., published 2011-03-15) / --------------------------------^ base.f90(37): error #5145: Invalid blank/tab Unicode 6.0. */ ---------------^ base.f90(39): error #5145: Invalid blank/tab /* We do not support C11 <threads.h>. */ -------------------------------------^ base.f90(1): catastrophic error: Could not recover from previous syntax error compilation aborted for base.f90 (code 1) makefile:306: recipe for target 'base.o' failed make: *** [base.o] Error 1 wjx@wjx-G480:~/vasp/vasp.5.2$ make ./preprocess <base.F | /usr/bin/cpp -P -C -traditional >base.f90 -DHOST=\"LinuxIFC\" -Dkind8 -DCACHE_SIZE=12000 -DPGF90 -Davoidalloc -DNGXhalf ifort -FR -lowercase -assume byterecl -O3 -c base.f90 ifort: command line remark #10148: option '-lowercase' not supported base.f90(1): error #5082: Syntax error, found '/' when expecting one of: <LABEL> <END-OF-STATEMENT> ; BLOCK PROGRAM BLOCKDATA MODULE INTEGER REAL COMPLEX ... /* Copyright (C) 1991-2014 Free Software Foundation, Inc. ^ base.f90(16): error #5145: Invalid blank/tab <http://www.gnu.org/licenses/>. */ ----------------------------------^ base.f90(20): error #5145: Invalid blank/tab include it implicitly at the start of every compilation. It must -----------------------------------------------------------^ base.f90(27): error #5120: Unterminated character constant /* glibc's intent is to support the IEC 559 math functionality, real --------^ base.f90(27): error #5144: Invalid character_kind_parameter. No underscore /* glibc's intent is to support the IEC 559 math functionality, real --------------------------------------------------------------------^ base.f90(28): error #5145: Invalid blank/tab and complex. If the GCC (4.9 and later) predefined macros ---------------^ base.f90(30): error #5277: Syntax error, found ',' following statement keyword whether the overall intent is to support these features; otherwise, ----------------------------------------------------------------------^ base.f90(32): error #5145: Invalid blank/tab define these macros by default. */ ----------------------------------^ base.f90(36): error #5143: Missing mandatory separating blank /* wchar_t uses ISO/IEC 10646 (2nd ed., published 2011-03-15) / --------------------------------^ base.f90(37): error #5145: Invalid blank/tab Unicode 6.0. */ ---------------^ base.f90(39): error #5145: Invalid blank/tab /* We do not support C11 <threads.h>. */ -------------------------------------^ base.f90(1): catastrophic error: Could not recover from previous syntax error compilation aborted for base.f90 (code 1) makefile:306: recipe for target 'base.o' failed make: *** [base.o] Error 1 wjx@wjx-G480:~/vasp/vasp.5.2$ make ./preprocess <base.F | /usr/bin/cpp -P -C -traditional >base.f90 -DHOST=\"LinuxIFC\" -Dkind8 -DCACHE_SIZE=12000 -DPGF90 -Davoidalloc -DNGXhalf ifort -FR -lowercase -assume byterecl -O3 -c base.f90 ifort: command line remark #10148: option '-lowercase' not supported base.f90(1): error #5082: Syntax error, found '/' when expecting one of: <LABEL> <END-OF-STATEMENT> ; BLOCK PROGRAM BLOCKDATA MODULE INTEGER REAL COMPLEX ... /* Copyright (C) 1991-2014 Free Software Foundation, Inc. ^ base.f90(16): error #5145: Invalid blank/tab <http://www.gnu.org/licenses/>. */ ----------------------------------^ base.f90(20): error #5145: Invalid blank/tab include it implicitly at the start of every compilation. It must -----------------------------------------------------------^ base.f90(27): error #5120: Unterminated character constant /* glibc's intent is to support the IEC 559 math functionality, real --------^ base.f90(27): error #5144: Invalid character_kind_parameter. No underscore /* glibc's intent is to support the IEC 559 math functionality, real --------------------------------------------------------------------^ base.f90(28): error #5145: Invalid blank/tab and complex. If the GCC (4.9 and later) predefined macros ---------------^ base.f90(30): error #5277: Syntax error, found ',' following statement keyword whether the overall intent is to support these features; otherwise, ----------------------------------------------------------------------^ base.f90(32): error #5145: Invalid blank/tab define these macros by default. */ ----------------------------------^ base.f90(36): error #5143: Missing mandatory separating blank /* wchar_t uses ISO/IEC 10646 (2nd ed., published 2011-03-15) / --------------------------------^ base.f90(37): error #5145: Invalid blank/tab Unicode 6.0. */ ---------------^ base.f90(39): error #5145: Invalid blank/tab /* We do not support C11 <threads.h>. */ -------------------------------------^ base.f90(1): catastrophic error: Could not recover from previous syntax error compilation aborted for base.f90 (code 1) makefile:306: recipe for target 'base.o' failed make: *** [base.o] Error 1 wjx@wjx-G480:~/vasp/vasp.5.2$ |
回復(fù)此樓» 猜你喜歡
哈爾濱理工大學(xué)物理系招收物理學(xué)考研調(diào)劑
已經(jīng)有7人回復(fù)
-
0702一志愿吉大B區(qū)求調(diào)劑
已經(jīng)有5人回復(fù)
-
物理學(xué)I論文潤(rùn)色/翻譯怎么收費(fèi)?
已經(jīng)有250人回復(fù)
-
求調(diào)劑
已經(jīng)有0人回復(fù)
-
0702一志愿吉大B區(qū)求調(diào)劑有論文
已經(jīng)有0人回復(fù)
-
請(qǐng)問還有沒有用Latex寫文章的小伙伴們？
已經(jīng)有0人回復(fù)
-
光學(xué)工程學(xué)碩調(diào)劑信息
已經(jīng)有31人回復(fù)
-
歡迎加入課題組
已經(jīng)有0人回復(fù)
-
散金幣，求好運(yùn)，祝面上順利！
已經(jīng)有68人回復(fù)
-
華東師范大學(xué)芯片設(shè)計(jì)徐瓏真實(shí)水平咋樣
已經(jīng)有1人回復(fù)
-
調(diào)劑
已經(jīng)有0人回復(fù)
» 本主題相關(guān)價(jià)值貼推薦，對(duì)您同樣有幫助:
- vasp 5.2 安裝過程 (串行+并行）+(32位+64位) + ifort +intel MKL+ openmpi
已經(jīng)有47人回復(fù)
- 求助VASP用的Intel ifort icc 編譯器
已經(jīng)有9人回復(fù)
- VASP怎么安裝？安裝在什么系統(tǒng)下啊？
已經(jīng)有4人回復(fù)
- vasp5.3安裝問題求助
已經(jīng)有8人回復(fù)
- 請(qǐng)問單機(jī)裝VASP，裝并行好還是串行好？
已經(jīng)有15人回復(fù)
- 單機(jī)編譯安裝vasp求指導(dǎo)
已經(jīng)有10人回復(fù)
- 新手vasp安裝求助
已經(jīng)有11人回復(fù)
- VASP XCrysDenPWscf 單機(jī)安裝教程(linux)
已經(jīng)有12人回復(fù)
- 求助：VASP 安裝
已經(jīng)有17人回復(fù)
- 【求助】vasp安裝編譯錯(cuò)誤，請(qǐng)大家?guī)兔聪履抢锍鲥e(cuò)了。
已經(jīng)有6人回復(fù)
- 【求助】菜鳥問有關(guān)VASP作業(yè)提交的問題！
已經(jīng)有21人回復(fù)
- 【求助成功】vasp5.2并行安裝不上
已經(jīng)有18人回復(fù)
- 【求助】mpi vasp問題
已經(jīng)有32人回復(fù)
- 【求助】vasp并行安裝mpich2的錯(cuò)誤
已經(jīng)有10人回復(fù)
- 【求助】vasp LDA+U 讀取出錯(cuò)問題
已經(jīng)有5人回復(fù)
- 【求助】求vasp.4.6 安裝必備軟件
已經(jīng)有13人回復(fù)
nanost
木蟲 (知名作家)
Dr.
- 應(yīng)助: 35 (小學(xué)生)
- 金幣: 4696.6
- 散金: 228
- 紅花: 18
- 帖子: 5211
- 在線: 1195.5小時(shí)
- 蟲號(hào): 195830
- 注冊(cè): 2006-02-23
- 性別: GG
- 專業(yè): 無機(jī)合成和制備化學(xué)
|
makefile文件 .SUFFIXES: .inc .f .f90 .F #----------------------------------------------------------------------- # Makefile for Intel Fortran compiler for Pentium/Athlon/Opteron # bases systems # we recommend this makefile for both Intel as well as AMD systems # for AMD based systems appropriate BLAS and fftw libraries are # however mandatory (whereas they are optional for Intel platforms) # # The makefile was tested only under Linux on Intel and AMD platforms # the following compiler versions have been tested: # - ifc.7.1 works stable somewhat slow but reliably # - ifc.8.1 fails to compile the code properly # - ifc.9.1 recommended (both for 32 and 64 bit) # - ifc.10.1 partially recommended (both for 32 and 64 bit) # tested build 20080312 Package ID: l_fc_p_10.1.015 # the gamma only mpi version can not be compiles # using ifc.10.1 # # it might be required to change some of library pathes, since # LINUX installation vary a lot # Hence check ***ALL*** options in this makefile very carefully #----------------------------------------------------------------------- # # BLAS must be installed on the machine # there are several options: # 1) very slow but works: # retrieve the lapackage from ftp.netlib.org # and compile the blas routines (BLAS/SRC directory) # please use g77 or f77 for the compilation. When I tried to # use pgf77 or pgf90 for BLAS, VASP hang up when calling # ZHEEV (however this was with lapack 1.1 now I use lapack 2.0) # 2) more desirable: get an optimized BLAS # # the two most reliable packages around are presently: # 2a) Intels own optimised BLAS (PIII, P4, PD, PC2, Itanium) # http://developer.intel.com/software/products/mkl/ # this is really excellent, if you use Intel CPU's # # 2b) probably fastest SSE2 (4 GFlops on P4, 2.53 GHz, 16 GFlops PD, # around 30 GFlops on Quad core) # Kazushige Goto's BLAS # http://www.cs.utexas.edu/users/kgoto/signup_first.html # http://www.tacc.utexas.edu/resources/software/ # #----------------------------------------------------------------------- # all CPP processed fortran files have the extension .f90 SUFFIX=.f90 #----------------------------------------------------------------------- # fortran compiler and linker #----------------------------------------------------------------------- FC=ifort # fortran linker FCL=$(FC) #----------------------------------------------------------------------- # whereis CPP ?? (I need CPP, can't use gcc with proper options) # that's the location of gcc for SUSE 5.3 # # CPP_ = /usr/lib/gcc-lib/i486-linux/2.7.2/cpp -P -C # # that's probably the right line for some Red Hat distribution: # # CPP_ = /usr/lib/gcc-lib/i386-redhat-linux/2.7.2.3/cpp -P -C # # SUSE X.X, maybe some Red Hat distributions: CPP_ = ./preprocess <$*.F | /usr/bin/cpp -P -C -traditional >$*$(SUFFIX) #----------------------------------------------------------------------- # possible options for CPP: # NGXhalf charge density reduced in X direction # wNGXhalf gamma point only reduced in X direction # avoidalloc avoid ALLOCATE if possible # PGF90 work around some for some PGF90 / IFC bugs # CACHE_SIZE 1000 for PII,PIII, 5000 for Athlon, 8000-12000 P4, PD # RPROMU_DGEMV use DGEMV instead of DGEMM in RPRO (depends on used BLAS) # RACCMU_DGEMV use DGEMV instead of DGEMM in RACC (depends on used BLAS) #----------------------------------------------------------------------- CPP = $(CPP_) -DHOST=\"LinuxIFC\" \ -Dkind8 -DCACHE_SIZE=12000 -DPGF90 -Davoidalloc -DNGXhalf \ # -DRPROMU_DGEMV -DRACCMU_DGEMV #----------------------------------------------------------------------- # general fortran flags (there must a trailing blank on this line) # byterecl is strictly required for ifc, since otherwise # the WAVECAR file becomes huge #----------------------------------------------------------------------- FFLAGS = -FR -lowercase -assume byterecl #----------------------------------------------------------------------- # optimization # we have tested whether higher optimisation improves performance # -axK SSE1 optimization, but also generate code executable on all mach. # xK improves performance somewhat on XP, and a is required in order # to run the code on older Athlons as well # -xW SSE2 optimization # -axW SSE2 optimization, but also generate code executable on all mach. # -tpp6 P3 optimization # -tpp7 P4 optimization #----------------------------------------------------------------------- # ifc.9.1, ifc.10.1 recommended OFLAG=-O3 OFLAG_HIGH = $(OFLAG) OBJ_HIGH = OBJ_NOOPT = DEBUG = -FR -O0 INLINE = $(OFLAG) #----------------------------------------------------------------------- # the following lines specify the position of BLAS and LAPACK # VASP works fastest with the libgoto library # so that's what we recommend #----------------------------------------------------------------------- # mkl.10.0 # set -DRPROMU_DGEMV -DRACCMU_DGEMV in the CPP lines BLAS=-L/opt/intel/composer_xe_2015.1.133/mkl/lib/intel64 -lmkl_intel_lp64 -lmkl_sequential -lpthread -lmkl_core # even faster for VASP Kazushige Goto's BLAS # http://www.cs.utexas.edu/users/kgoto/signup_first.html # parallel goto version requires sometimes -libverbs #BLAS= /opt/libs/libgoto/libgoto.so # LAPACK, simplest use vasp.5.lib/lapack_double #LAPACK= ../vasp.5.lib/lapack_double.o # use the mkl Intel lapack LAPACK=-L/opt/intel/composer_xe_2015.1.133/mkl/lib/intel64 -lmkl_intel_lp64 -lmkl_sequential -lpthread -lmkl_core -lmkl_lapack95_lp64 #----------------------------------------------------------------------- LIB = -L../vasp.5.lib -ldmy \ ../vasp.5.lib/linpack_double.o $(LAPACK) \ $(BLAS) # options for linking, nothing is required (usually) LINK = #----------------------------------------------------------------------- # fft libraries: # VASP.5.2 can use fftw.3.1.X (http://www.fftw.org) # since this version is faster on P4 machines, we recommend to use it #----------------------------------------------------------------------- FFT3D = fft3dfurth.o fft3dlib.o /opt/fftw/lib/libfftw3.a # alternatively: fftw.3.1.X is slighly faster and should be used if available #FFT3D = fftw3d.o fft3dlib.o /opt/libs/fftw-3.1.2/lib/libfftw3.a #======================================================================= # MPI section, uncomment the following lines until # general rules and compile lines # presently we recommend OPENMPI, since it seems to offer better # performance than lam or mpich # # !!! Please do not send me any queries on how to install MPI, I will # certainly not answer them !!!! #======================================================================= #----------------------------------------------------------------------- # fortran linker for mpi #----------------------------------------------------------------------- #FC=mpif77 #FCL=$(FC) |
2樓2015-02-03 23:28:42
nanost
木蟲 (知名作家)
Dr.
- 應(yīng)助: 35 (小學(xué)生)
- 金幣: 4696.6
- 散金: 228
- 紅花: 18
- 帖子: 5211
- 在線: 1195.5小時(shí)
- 蟲號(hào): 195830
- 注冊(cè): 2006-02-23
- 性別: GG
- 專業(yè): 無機(jī)合成和制備化學(xué)
3樓2015-02-03 23:29:11
ifmc1234
木蟲 (著名寫手)
- 應(yīng)助: 18 (小學(xué)生)
- 金幣: 2797.9
- 散金: 6001
- 紅花: 14
- 帖子: 1761
- 在線: 572.6小時(shí)
- 蟲號(hào): 825500
- 注冊(cè): 2009-08-10
- 專業(yè): 理論和計(jì)算化學(xué)
4樓2015-05-29 20:41:59
ifmc1234
木蟲 (著名寫手)
- 應(yīng)助: 18 (小學(xué)生)
- 金幣: 2797.9
- 散金: 6001
- 紅花: 14
- 帖子: 1761
- 在線: 572.6小時(shí)
- 蟲號(hào): 825500
- 注冊(cè): 2009-08-10
- 專業(yè): 理論和計(jì)算化學(xué)
5樓2015-05-30 15:32:49
相關(guān)版塊跳轉(zhuǎn)
我要訂閱樓主 nanost 的主題更新
| 5 | 1/1 | 返回列表 |
| 最具人氣熱帖推薦 [查看全部] | 作者 | 回/看 | 最后發(fā)表 | |
|---|---|---|---|---|
|
[考研] 384求調(diào)劑 +3 | 子系博 2026-03-22 | 4/200 |
|
|---|---|---|---|---|
|
[考研] 286分人工智能專業(yè)請(qǐng)求調(diào)劑愿意跨考！ +4 | lemonzzn 2026-03-17 | 8/400 |
|
|
|
[考研] 280求調(diào)劑 +11 | 咕嚕曉曉 2026-03-18 | 12/600 |
|
|
|
[考研] 化學(xué)調(diào)劑 +5 | yzysaa 2026-03-21 | 5/250 |
|
|
|
[考研] 化學(xué)工程321分求調(diào)劑 +18 | 大米飯！ 2026-03-15 | 22/1100 |
|
|
|
[考研] 求調(diào)劑 +4 | 要好好無聊 2026-03-21 | 4/200 |
|
|
|
[考研] 311求調(diào)劑 +3 | 勇敢的小吳 2026-03-20 | 3/150 |
|
|
|
[考研] 296求調(diào)劑 +4 | www_q 2026-03-20 | 4/200 |
|
|
|
[考研] 332求調(diào)劑 +3 | 鳳凰院丁真 2026-03-20 | 3/150 |
|
|
|
[考研] 材料學(xué)學(xué)碩080502 337求調(diào)劑-一志愿華中科技大學(xué) +4 | 順順順mr 2026-03-18 | 5/250 |
|
|
|
[考研] 346求調(diào)劑[0856] +4 | WayneLim327 2026-03-16 | 7/350 |
|
|
|
[考研] 332求調(diào)劑 +4 | ydfyh 2026-03-17 | 4/200 |
|
|
|
[考研] 一志愿華中科技大學(xué)，080502，354分求調(diào)劑 +5 | 守候夕陽CF 2026-03-18 | 5/250 |
|
|
|
[考研] 311求調(diào)劑 +5 | 冬十三 2026-03-18 | 5/250 |
|
|
|
[考研] 一志愿中南化學(xué)（0703）總分337求調(diào)劑 +8 | niko- 2026-03-19 | 9/450 |
|
|
|
[考研] 290求調(diào)劑 +7 | ^O^乜 2026-03-19 | 7/350 |
|
|
|
[考研] 一志愿南理工085701環(huán)境302求調(diào)劑院校 +3 | 葵梓衛(wèi)隊(duì) 2026-03-20 | 3/150 |
|
|
|
[考研] 考研求調(diào)劑 +3 | 橘頌. 2026-03-17 | 4/200 |
|
|
|
[考研] 283求調(diào)劑 +3 | 聽風(fēng)就是雨； 2026-03-16 | 3/150 |
|
|
|
[考研] 070303 總分349求調(diào)劑 +3 | LJY9966 2026-03-15 | 5/250 |
|